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data/benchmarks/DTA_test_metrics.csv
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1 |
+
"Model","Type","Scenario","Family","CI","Mean.squared.error","Pearson","loss"
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2 |
+
"MolTrans","Family","Random Split","Kinase",0.774481117725372,0.713657200336456,0.747699677944183,0.713657200336456
|
3 |
+
"HyperAttentionDTI","Family","Random Split","Kinase",0.834485709667206,0.445911228656769,0.852790713310242,0.445911228656769
|
4 |
+
"TransformerCPI","Family","Random Split","Kinase",0.807378768920898,0.573384821414948,0.813709020614624,0.573384821414948
|
5 |
+
"TransformerCPI2","Family","Random Split","Kinase",0.8319091796875,0.461714267730713,0.852632343769073,0.461714267730713
|
6 |
+
"GraphDTA","General","Random Split","All Families",0.705847322940826,1.21765768527985,0.605182647705078,1.21765768527985
|
7 |
+
"DeepDTA","Family","Random Split","Kinase",0.733844459056854,0.943923652172089,0.661100745201111,0.943923652172089
|
8 |
+
"GraphDTA","Family","Random Split","Kinase",0.640740573406219,1.31500744819641,0.42966765165329,1.31500744819641
|
9 |
+
"DeepConvDTI","Family","Random Split","Kinase",0.847200870513916,0.394984185695648,0.870539128780365,0.394984185695648
|
10 |
+
"DrugVQA-Seq","Family","Random Split","Kinase",0.682981729507446,1.13045275211334,0.545935451984406,1.13993966579437
|
11 |
+
"DrugBAN","Family","Random Split","Kinase",0.743643820285797,0.913918673992157,0.683148682117462,0.913918673992157
|
12 |
+
"MGraphDTA","Family","Random Split","Kinase",0.844852447509766,5.95101070404053,0.378337681293487,5.95101070404053
|
13 |
+
"DeepDTA","Family","Random Split","Ion Channel",0.759286463260651,0.709448158740997,0.709150493144989,0.709448158740997
|
14 |
+
"GraphDTA","Family","Random Split","Ion Channel",0.723597705364227,0.845416128635406,0.652099907398224,0.845416128635406
|
15 |
+
"HyperAttentionDTI","Family","Random Split","Ion Channel",0.83079582452774,0.413987845182419,0.845265686511993,0.413987845182419
|
16 |
+
"DeepConvDTI","Family","Random Split","Ion Channel",0.835472762584686,0.390018820762634,0.861531615257263,0.390018820762634
|
17 |
+
"DrugVQA-Seq","Family","Random Split","Ion Channel",0.733958899974823,0.820592641830444,0.648799479007721,0.830079615116119
|
18 |
+
"MGraphDTA","Family","Random Split","Ion Channel",0.837305426597595,0.395314007997513,0.854628384113312,0.395314007997513
|
19 |
+
"MolTrans","Family","Random Split","Ion Channel",0.789132654666901,0.584269225597382,0.776615977287292,0.584269225597382
|
20 |
+
"DrugBAN","Family","Random Split","Ion Channel",0.769394516944885,0.696805536746979,0.740205466747284,0.696805536746979
|
21 |
+
"TransformerCPI2","Family","Random Split","Ion Channel",0.82897961139679,0.427298247814178,0.847677886486053,0.427298247814178
|
22 |
+
"TransformerCPI","Family","Random Split","Ion Channel",0.818316340446472,0.481687933206558,0.829353749752045,0.481687933206558
|
23 |
+
"HyperAttentionDTI","General","Random Split","All Families",0.833706796169281,0.499331712722778,0.857560932636261,0.499331712722778
|
24 |
+
"MolTrans","General","Random Split","All Families",0.799312651157379,0.71259069442749,0.800659894943237,0.71259069442749
|
25 |
+
"MolTrans","Family","Random Split","Membrane Receptor",0.748823702335358,0.845507442951202,0.703236997127533,0.845507442951202
|
26 |
+
"MolTrans","Family","Random Split","Nuclear Receptor",0.785199463367462,2.7883620262146,0.751469135284424,2.7883620262146
|
27 |
+
"TransformerCPI2","Family","Random Split","Nuclear Receptor",0.820063710212708,0.438576251268387,0.843425333499908,0.438576251268387
|
28 |
+
"MolTrans","Family","Random Split","Others",0.797718644142151,0.75921505689621,0.812727391719818,0.75921505689621
|
29 |
+
"TransformerCPI2","Family","Random Split","Membrane Receptor",0.810385167598724,0.548347234725952,0.823661863803864,0.548347234725952
|
30 |
+
"MolTrans","Family","Random Split","Non-Kinase Enzyme",0.787220776081085,0.808076024055481,0.775075614452362,0.808076024055481
|
31 |
+
"TransformerCPI2","Family","Random Split","Others",0.860322713851929,0.390428572893143,0.911834359169006,0.390428572893143
|
32 |
+
"TransformerCPI2","Family","Random Split","Non-Kinase Enzyme",0.843909561634064,0.477157741785049,0.872050404548645,0.477157741785049
|
33 |
+
"DeepDTA","General","Random Split","All Families",0.758285820484161,0.920573651790619,0.716958343982697,0.920573651790619
|
34 |
+
"DeepConvDTI","General","Random Split","All Families",0.842196702957153,0.47245928645134,0.867253065109253,0.47245928645134
|
35 |
+
"DrugVQA-Seq","General","Random Split","All Families",0.722485423088074,1.12567055225372,0.643841207027435,1.13515758514404
|
36 |
+
"DrugBAN","General","Random Split","All Families",0.790678679943085,0.739305257797241,0.785269320011139,0.739305257797241
|
37 |
+
"MGraphDTA","General","Random Split","All Families",0.843245267868042,0.460183918476105,0.869000673294067,0.460183918476105
|
38 |
+
"DeepDTA","Family","Random Split","Membrane Receptor",0.725795149803162,0.961202919483185,0.647390365600586,0.961202919483185
|
39 |
+
"DeepConvDTI","Family","Random Split","Membrane Receptor",0.821846902370453,0.514527499675751,0.829956650733948,0.514527499675751
|
40 |
+
"GraphDTA","Family","Random Split","Membrane Receptor",0.707503795623779,1.03874588012695,0.604564130306244,1.03874588012695
|
41 |
+
"HyperAttentionDTI","Family","Random Split","Membrane Receptor",0.807940423488617,0.560003042221069,0.812271773815155,0.560003042221069
|
42 |
+
"DrugVQA-Seq","Family","Random Split","Membrane Receptor",0.703162908554077,1.09267950057983,0.587225496768951,1.10216617584229
|
43 |
+
"DeepDTA","Family","Random Split","Non-Kinase Enzyme",0.742023527622223,1.03590488433838,0.677158832550049,1.03590488433838
|
44 |
+
"MGraphDTA","Family","Random Split","Membrane Receptor",0.811075985431671,0.570244073867798,0.812301695346832,0.570244073867798
|
45 |
+
"DrugBAN","Family","Random Split","Membrane Receptor",0.74816620349884,0.984752058982849,0.693331778049469,0.984752058982849
|
46 |
+
"GraphDTA","Family","Random Split","Non-Kinase Enzyme",0.706236600875854,1.23245942592621,0.595292747020721,1.23245942592621
|
47 |
+
"DeepConvDTI","Family","Random Split","Non-Kinase Enzyme",0.84122496843338,0.477090269327164,0.867855429649353,0.477090269327164
|
48 |
+
"HyperAttentionDTI","Family","Random Split","Non-Kinase Enzyme",0.838615596294403,0.49684751033783,0.861431777477264,0.49684751033783
|
49 |
+
"DrugVQA-Seq","Family","Random Split","Non-Kinase Enzyme",0.724906027317047,1.17525064945221,0.628734230995178,1.18473732471466
|
50 |
+
"DeepDTA","Family","Random Split","Nuclear Receptor",0.754663527011871,0.739940464496613,0.714239895343781,0.739940464496613
|
51 |
+
"GraphDTA","Family","Random Split","Nuclear Receptor",0.717030167579651,0.915820121765137,0.609534800052643,0.915820121765137
|
52 |
+
"TransformerCPI","Family","Random Split","Membrane Receptor",0.785535156726837,0.650558829307556,0.778399586677551,0.650558829307556
|
53 |
+
"DeepConvDTI","Family","Random Split","Nuclear Receptor",0.814183413982391,0.678979158401489,0.81740939617157,0.678979158401489
|
54 |
+
"MGraphDTA","Family","Random Split","Nuclear Receptor",0.808936178684235,0.509399175643921,0.805209875106812,0.509399175643921
|
55 |
+
"HyperAttentionDTI","Family","Random Split","Nuclear Receptor",0.822330832481384,0.434580415487289,0.840283036231995,0.434580415487289
|
56 |
+
"DrugVQA-Seq","Family","Random Split","Nuclear Receptor",0.725537717342377,0.835657954216003,0.643980741500854,0.845144808292389
|
57 |
+
"DeepDTA","Family","Random Split","Others",0.792243957519531,0.775000095367432,0.808080852031708,0.775000095367432
|
58 |
+
"MGraphDTA","Family","Random Split","Non-Kinase Enzyme",0.836128652095795,0.506910741329193,0.857060074806213,0.506910741329193
|
59 |
+
"DrugBAN","Family","Random Split","Nuclear Receptor",0.775486052036285,0.715480029582977,0.762210965156555,0.715480029582977
|
60 |
+
"GraphDTA","Family","Random Split","Others",0.764753639698029,1.00290405750275,0.748647630214691,1.00290405750275
|
61 |
+
"DrugBAN","Family","Random Split","Non-Kinase Enzyme",0.78702449798584,0.795085906982422,0.772006988525391,0.795085906982422
|
62 |
+
"DeepConvDTI","Family","Random Split","Others",0.862395763397217,0.387639135122299,0.908657252788544,0.387639135122299
|
63 |
+
"HyperAttentionDTI","Family","Random Split","Others",0.861282467842102,0.392622798681259,0.907700598239899,0.392622798681259
|
64 |
+
"DrugVQA-Seq","Family","Random Split","Others",0.769073784351349,1.07364296913147,0.763491153717041,1.0831298828125
|
65 |
+
"TransformerCPI","Family","Random Split","Nuclear Receptor",0.810258150100708,0.503987967967987,0.817083477973938,0.503987967967987
|
66 |
+
"MGraphDTA","Family","Random Split","Others",0.861548542976379,0.397870987653732,0.905309200286865,0.397870987653732
|
67 |
+
"DrugBAN","Family","Random Split","Others",0.831105291843414,0.559003353118896,0.869257152080536,0.559003353118896
|
68 |
+
"TransformerCPI","Family","Random Split","Others",0.847633421421051,0.458692967891693,0.894868731498718,0.458692967891693
|
69 |
+
"TransformerCPI","Family","Random Split","Non-Kinase Enzyme",0.812927782535553,0.627496182918549,0.826390624046326,0.627496182918549
|
70 |
+
"TransformerCPI","General","Seen Compound","Nuclear Receptor",0.708016276359558,0.92618978023529,0.615138649940491,0.92618978023529
|
71 |
+
"TransformerCPI","General","Unseen Compound","Nuclear Receptor",0.632114708423615,1.03986752033234,0.570561468601227,1.03986752033234
|
72 |
+
"TransformerCPI","General","Unseen Compound","Membrane Receptor",0.662633657455444,1.00440835952759,0.551086127758026,1.00440835952759
|
73 |
+
"TransformerCPI","General","Seen Compound","Membrane Receptor",0.743709206581116,0.876446783542633,0.735727906227112,0.876446783542633
|
74 |
+
"TransformerCPI","General","Seen Compound","Kinase",0.711297512054443,0.849550724029541,0.689496517181396,0.849550724029541
|
75 |
+
"TransformerCPI","General","Unseen Compound","Others",0.677593171596527,0.81035041809082,0.703662037849426,0.81035041809082
|
76 |
+
"TransformerCPI","General","Seen Compound","Others",0.741951942443848,0.753956854343414,0.70870840549469,0.753956854343414
|
77 |
+
"TransformerCPI","General","Unseen Compound","Kinase",0.71192729473114,1.03369116783142,0.651526570320129,1.03369116783142
|
78 |
+
"TransformerCPI","General","Seen Compound","Ion Channel",0.686135113239288,1.1561176776886,0.558277606964111,1.1561176776886
|
79 |
+
"TransformerCPI","General","Unseen Compound","Non-Kinase Enzyme",0.70577073097229,1.02862811088562,0.687556326389313,1.02862811088562
|
80 |
+
"TransformerCPI","General","Seen Compound","Non-Kinase Enzyme",0.741826295852661,0.861979126930237,0.738841831684113,0.861979126930237
|
81 |
+
"TransformerCPI","General","Seen Target","Nuclear Receptor",0.646303176879883,1.18509066104889,0.542770445346832,1.18509066104889
|
82 |
+
"TransformerCPI","General","Unseen Compound","Ion Channel",0.667874336242676,0.878237903118134,0.692878484725952,0.878237903118134
|
83 |
+
"TransformerCPI","General","Unseen Target","Nuclear Receptor",0.595697999000549,2.22638416290283,0.280790537595749,2.22638416290283
|
84 |
+
"TransformerCPI","General","Seen Target","Membrane Receptor",0.615869879722595,1.23073661327362,0.350900501012802,1.23073661327362
|
85 |
+
"TransformerCPI","General","Unseen Target","Membrane Receptor",0.57085645198822,1.81425786018372,0.18704280257225,1.81425786018372
|
86 |
+
"TransformerCPI","General","Seen Target","Kinase",0.72142094373703,0.986519873142242,0.610646605491638,0.986519873142242
|
87 |
+
"TransformerCPI","General","Unseen Target","Others",0.570834100246429,1.39704084396362,0.200649678707123,1.39704084396362
|
88 |
+
"TransformerCPI","General","Seen Target","Others",0.67502373456955,1.05984270572662,0.533345282077789,1.05984270572662
|
89 |
+
"TransformerCPI","General","Unseen Target","Kinase",0.585041582584381,1.55164134502411,0.32108548283577,1.55164134502411
|
90 |
+
"TransformerCPI","General","Seen Target","Ion Channel",0.657233715057373,0.64962637424469,0.723869919776917,0.64962637424469
|
91 |
+
"TransformerCPI","General","Unseen Target","Non-Kinase Enzyme",0.578232824802399,2.04762244224548,0.398736178874969,2.04762244224548
|
92 |
+
"TransformerCPI","General","Seen Target","Non-Kinase Enzyme",0.629581809043884,1.33481335639954,0.464666038751602,1.33481335639954
|
93 |
+
"TransformerCPI","General","Unseen Target","Ion Channel",0.618912279605865,1.31887435913086,0.223135083913803,1.31887435913086
|
94 |
+
"TransformerCPI","General","Seen Target","All Families",0.660597085952759,1.12999641895294,0.529916346073151,1.12999641895294
|
95 |
+
"TransformerCPI","General","Unseen Compound","All Families",0.690551042556763,0.957880973815918,0.708456575870514,0.957880973815918
|
96 |
+
"TransformerCPI","General","Seen Compound","All Families",0.739646911621094,0.857052981853485,0.732759118080139,0.857052981853485
|
97 |
+
"TransformerCPI","General","Unseen Target","All Families",0.565901398658752,1.73884046077728,0.318575918674469,1.73884046077728
|
98 |
+
"TransformerCPI2","General","Unseen Target","All Families",0.576788127422333,1.5619752407074,0.399984508752823,1.5619752407074
|
99 |
+
"TransformerCPI2","General","Seen Target","All Families",0.705245077610016,0.970081865787506,0.61810427904129,0.970081865787506
|
100 |
+
"TransformerCPI2","General","Unseen Compound","All Families",0.648567497730255,0.982667446136475,0.687315583229065,0.982667446136475
|
101 |
+
"TransformerCPI2","General","Seen Compound","All Families",0.70781135559082,0.779470443725586,0.751595795154572,0.779470443725586
|
102 |
+
"TransformerCPI2","General","Seen Compound","Nuclear Receptor",0.647826075553894,0.889351069927216,0.615885436534882,0.889351069927216
|
103 |
+
"TransformerCPI2","General","Unseen Compound","Nuclear Receptor",0.641537487506866,1.01508343219757,0.586835265159607,1.01508343219757
|
104 |
+
"TransformerCPI2","General","Seen Compound","Membrane Receptor",0.723385989665985,0.885864019393921,0.732182204723358,0.885864019393921
|
105 |
+
"TransformerCPI2","General","Unseen Compound","Membrane Receptor",0.612150073051453,1.12888491153717,0.464070111513138,1.12888491153717
|
106 |
+
"TransformerCPI2","General","Seen Compound","Kinase",0.693383812904358,0.717343032360077,0.731122553348541,0.717343032360077
|
107 |
+
"TransformerCPI2","General","Unseen Compound","Kinase",0.689591467380524,0.963557958602905,0.66179347038269,0.963557958602905
|
108 |
+
"TransformerCPI2","General","Unseen Compound","Others",0.615323960781097,0.907517373561859,0.654627203941345,0.907517373561859
|
109 |
+
"TransformerCPI2","General","Seen Compound","Others",0.699474990367889,0.713277339935303,0.733327746391296,0.713277339935303
|
110 |
+
"TransformerCPI2","General","Seen Compound","Ion Channel",0.707750976085663,0.7719966173172,0.717628598213196,0.7719966173172
|
111 |
+
"TransformerCPI2","General","Unseen Compound","Ion Channel",0.633717119693756,0.804168939590454,0.702578842639923,0.804168939590454
|
112 |
+
"TransformerCPI2","General","Seen Target","Nuclear Receptor",0.707578420639038,1.03730714321136,0.601714909076691,1.03730714321136
|
113 |
+
"TransformerCPI2","General","Seen Compound","Non-Kinase Enzyme",0.711645603179932,0.774330854415894,0.7508305311203,0.774330854415894
|
114 |
+
"TransformerCPI2","General","Unseen Compound","Non-Kinase Enzyme",0.630950629711151,1.12751722335815,0.64039671421051,1.12751722335815
|
115 |
+
"TransformerCPI2","General","Unseen Target","Nuclear Receptor",0.614891409873962,2.01472330093384,0.369808703660965,2.01472330093384
|
116 |
+
"TransformerCPI2","General","Seen Target","Membrane Receptor",0.627633213996887,1.34438705444336,0.314834833145142,1.34438705444336
|
117 |
+
"TransformerCPI2","General","Unseen Target","Membrane Receptor",0.552891075611115,1.60098469257355,0.25366672873497,1.60098469257355
|
118 |
+
"TransformerCPI2","General","Unseen Target","Others",0.548910737037659,1.44113254547119,0.191040366888046,1.44113254547119
|
119 |
+
"TransformerCPI2","General","Unseen Target","Kinase",0.638199627399445,1.16796636581421,0.533734440803528,1.16796636581421
|
120 |
+
"TransformerCPI2","General","Seen Target","Kinase",0.778443992137909,0.664634048938751,0.754267811775208,0.664634048938751
|
121 |
+
"TransformerCPI2","General","Seen Target","Non-Kinase Enzyme",0.687819957733154,1.02068948745728,0.619930446147919,1.02068948745728
|
122 |
+
"TransformerCPI2","General","Seen Target","Others",0.726387023925781,0.830308675765991,0.672011196613312,0.830308675765991
|
123 |
+
"TransformerCPI2","General","Seen Target","Ion Channel",0.700214564800262,0.691827416419983,0.710883915424347,0.691827416419983
|
124 |
+
"TransformerCPI2","General","Unseen Target","Ion Channel",0.530415773391724,1.41456198692322,0.222673997282982,1.41456198692322
|
125 |
+
"TransformerCPI2","General","Unseen Target","Non-Kinase Enzyme",0.552426338195801,2.07927989959717,0.38014754652977,2.07927989959717
|
126 |
+
"MolTrans","Family","Seen Target","Ion Channel",0.677896976470947,0.578278660774231,0.757871806621552,0.578278660774231
|
127 |
+
"MolTrans","Family","Unseen Target","Ion Channel",0.528227567672729,1.52697360515594,0.381354182958603,1.52697360515594
|
128 |
+
"MolTrans","Family","Unseen Compound","Ion Channel",0.571366488933563,1.08175027370453,0.577855706214905,1.08175027370453
|
129 |
+
"MolTrans","Family","Seen Compound","Ion Channel",0.687632381916046,0.810274362564087,0.704089403152466,0.810274362564087
|
130 |
+
"TransformerCPI2","Family","Seen Target","Ion Channel",0.685622334480286,0.869334638118744,0.645919978618622,0.869334638118744
|
131 |
+
"TransformerCPI2","Family","Unseen Compound","Ion Channel",0.651097118854523,0.870584845542908,0.681569814682007,0.870584845542908
|
132 |
+
"TransformerCPI2","Family","Unseen Target","Ion Channel",0.543763697147369,2.15649747848511,0.0740024372935295,2.15649747848511
|
133 |
+
"TransformerCPI2","Family","Seen Compound","Ion Channel",0.681914448738098,1.2789009809494,0.518817067146301,1.2789009809494
|
134 |
+
"TransformerCPI","Family","Unseen Target","Ion Channel",0.609057247638702,1.17361760139465,0.271519809961319,1.17361760139465
|
135 |
+
"TransformerCPI","Family","Seen Target","Ion Channel",0.661060810089111,0.637057542800903,0.73687356710434,0.637057542800903
|
136 |
+
"TransformerCPI","Family","Unseen Compound","Ion Channel",0.706579029560089,0.698221504688263,0.754553377628326,0.698221504688263
|
137 |
+
"TransformerCPI","Family","Seen Compound","Ion Channel",0.727001786231995,1.12907600402832,0.597370028495789,1.12907600402832
|
138 |
+
"DrugVQA-Seq","Family","Seen Target","Kinase",0.635904014110565,1.23658227920532,0.423521161079407,1.24606907367706
|
139 |
+
"DrugVQA-Seq","Family","Unseen Target","Kinase",0.612475275993347,1.50201821327209,0.334363579750061,1.51150488853455
|
140 |
+
"DrugVQA-Seq","Family","Seen Compound","Kinase",0.619832754135132,1.23339736461639,0.437655866146088,1.24288427829742
|
141 |
+
"DrugVQA-Seq","Family","Unseen Compound","Kinase",0.614979028701782,1.41962599754333,0.396195650100708,1.42911303043365
|
142 |
+
"GraphDTA","Family","Seen Target","Membrane Receptor",0.585719227790833,1.05273997783661,0.370728939771652,1.05273997783661
|
143 |
+
"GraphDTA","Family","Unseen Target","Membrane Receptor",0.546657860279083,1.56003248691559,0.068582184612751,1.56003248691559
|
144 |
+
"GraphDTA","Family","Seen Compound","Membrane Receptor",0.689022600650787,1.23545670509338,0.585488677024841,1.23545670509338
|
145 |
+
"GraphDTA","Family","Unseen Compound","Membrane Receptor",0.603186845779419,1.14899361133575,0.402986109256744,1.14899361133575
|
146 |
+
"GraphDTA","Family","Seen Target","Kinase",0.601887464523315,1.38277304172516,0.285259932279587,1.38277304172516
|
147 |
+
"GraphDTA","Family","Unseen Target","Kinase",0.619220435619354,1.52862977981567,0.267230063676834,1.52862977981567
|
148 |
+
"GraphDTA","Family","Seen Compound","Kinase",0.583134710788727,1.32840347290039,0.362098813056946,1.32840347290039
|
149 |
+
"GraphDTA","Family","Unseen Compound","Kinase",0.580299258232117,1.47953867912292,0.343948870897293,1.47953867912292
|
150 |
+
"DrugVQA-Seq","Family","Unseen Compound","Membrane Receptor",0.639805734157562,1.22639405727386,0.380876541137695,1.2358809709549
|
151 |
+
"DrugVQA-Seq","Family","Seen Compound","Membrane Receptor",0.676158428192139,1.2486766576767,0.571568012237549,1.25816333293915
|
152 |
+
"DrugVQA-Seq","Family","Seen Target","Membrane Receptor",0.615920841693878,1.0815703868866,0.405728459358215,1.09105730056763
|
153 |
+
"DrugVQA-Seq","Family","Unseen Target","Membrane Receptor",0.577107548713684,1.4379802942276,0.144590005278587,1.44746708869934
|
154 |
+
"MolTrans","Family","Seen Target","Nuclear Receptor",0.721020817756653,2.91752552986145,0.700520157814026,2.91752552986145
|
155 |
+
"MolTrans","Family","Unseen Target","Nuclear Receptor",0.603309214115143,7.41501808166504,0.0476489290595054,7.41501808166504
|
156 |
+
"MolTrans","Family","Unseen Compound","Nuclear Receptor",0.600764513015747,2.75240993499756,0.542729556560516,2.75240993499756
|
157 |
+
"MolTrans","Family","Seen Compound","Nuclear Receptor",0.701863348484039,2.9470694065094,0.658665657043457,2.9470694065094
|
158 |
+
"MolTrans","Family","Unseen Target","Non-Kinase Enzyme",0.539699137210846,2.16658544540405,0.292334407567978,2.16658544540405
|
159 |
+
"MolTrans","Family","Seen Target","Non-Kinase Enzyme",0.727602362632751,0.844205498695374,0.691325962543488,0.844205498695374
|
160 |
+
"MolTrans","Family","Seen Compound","Non-Kinase Enzyme",0.693545579910278,1.04584586620331,0.671692252159119,1.04584586620331
|
161 |
+
"MolTrans","Family","Unseen Compound","Non-Kinase Enzyme",0.618461668491364,1.14131820201874,0.650896608829498,1.14131820201874
|
162 |
+
"DeepConvDTI","Family","Seen Target","Membrane Receptor",0.782238364219666,0.502103865146637,0.780852496623993,0.502103865146637
|
163 |
+
"DeepConvDTI","Family","Unseen Target","Membrane Receptor",0.559758961200714,3.29202938079834,0.168892487883568,3.29202938079834
|
164 |
+
"DeepConvDTI","Family","Unseen Compound","Membrane Receptor",0.754880964756012,0.761191725730896,0.698315978050232,0.761191725730896
|
165 |
+
"DeepConvDTI","Family","Seen Compound","Membrane Receptor",0.811413824558258,0.608412146568298,0.825907409191132,0.608412146568298
|
166 |
+
"DeepConvDTI","Family","Seen Target","Kinase",0.83425360918045,0.403691530227661,0.85733950138092,0.403691530227661
|
167 |
+
"DeepConvDTI","Family","Unseen Target","Kinase",0.665458381175995,1.68092203140259,0.507396936416626,1.68092203140259
|
168 |
+
"DeepConvDTI","Family","Seen Compound","Kinase",0.82319164276123,0.441049784421921,0.84376460313797,0.441049784421921
|
169 |
+
"DeepConvDTI","Family","Unseen Compound","Kinase",0.776005268096924,0.624865770339966,0.798472940921783,0.624865770339966
|
170 |
+
"MolTrans","Family","Seen Target","Membrane Receptor",0.68826824426651,0.834553599357605,0.5607550740242,0.834553599357605
|
171 |
+
"MolTrans","Family","Unseen Target","Membrane Receptor",0.555845201015472,1.88418889045715,0.0671152845025062,1.88418889045715
|
172 |
+
"MolTrans","Family","Seen Compound","Membrane Receptor",0.699863731861115,0.95031350851059,0.695354759693146,0.95031350851059
|
173 |
+
"MolTrans","Family","Unseen Compound","Membrane Receptor",0.609798789024353,1.06502938270569,0.480940043926239,1.06502938270569
|
174 |
+
"MolTrans","Family","Unseen Compound","Kinase",0.653948426246643,1.08620595932007,0.603409767150879,1.08620595932007
|
175 |
+
"MolTrans","Family","Unseen Target","Kinase",0.601426839828491,1.5235550403595,0.348428934812546,1.5235550403595
|
176 |
+
"MolTrans","Family","Seen Target","Kinase",0.755608856678009,0.739892959594727,0.722417652606964,0.739892959594727
|
177 |
+
"MolTrans","Family","Seen Compound","Kinase",0.677039623260498,0.877535402774811,0.654079079627991,0.877535402774811
|
178 |
+
"MGraphDTA","Family","Seen Target","Membrane Receptor",0.779227733612061,0.504739999771118,0.769247651100159,0.504739999771118
|
179 |
+
"MGraphDTA","Family","Unseen Target","Membrane Receptor",0.571444571018219,1.75830578804016,0.230642110109329,1.75830578804016
|
180 |
+
"MGraphDTA","Family","Unseen Compound","Membrane Receptor",0.730683267116547,0.773239314556122,0.67439478635788,0.773239314556122
|
181 |
+
"MGraphDTA","Family","Seen Compound","Membrane Receptor",0.807655155658722,0.594891607761383,0.825376570224762,0.594891607761383
|
182 |
+
"MGraphDTA","Family","Seen Target","Kinase",0.833211541175842,0.416560590267181,0.852244317531586,0.416560590267181
|
183 |
+
"MGraphDTA","Family","Unseen Target","Kinase",0.650162935256958,1.72567558288574,0.393315076828003,1.72567558288574
|
184 |
+
"MGraphDTA","Family","Seen Compound","Kinase",0.79428768157959,0.532346308231354,0.808643698692322,0.532346308231354
|
185 |
+
"MGraphDTA","Family","Unseen Compound","Kinase",0.764725029468536,0.65506511926651,0.790395855903625,0.65506511926651
|
186 |
+
"HyperAttentionDTI","Family","Unseen Target","Membrane Receptor",0.577879965305328,1.70435619354248,0.190583676099777,1.70435619354248
|
187 |
+
"HyperAttentionDTI","Family","Seen Target","Membrane Receptor",0.757251024246216,0.567828416824341,0.735935926437378,0.567828416824341
|
188 |
+
"HyperAttentionDTI","Family","Seen Compound","Membrane Receptor",0.771043956279755,0.617136538028717,0.815818428993225,0.617136538028717
|
189 |
+
"HyperAttentionDTI","Family","Unseen Compound","Membrane Receptor",0.683981418609619,0.833582937717438,0.633202612400055,0.833582937717438
|
190 |
+
"HyperAttentionDTI","Family","Unseen Target","Kinase",0.649307310581207,1.38872945308685,0.446918070316315,1.38872945308685
|
191 |
+
"HyperAttentionDTI","Family","Seen Target","Kinase",0.815406441688538,0.453596502542496,0.83920419216156,0.453596502542496
|
192 |
+
"HyperAttentionDTI","Family","Unseen Compound","Kinase",0.708170711994171,0.76485013961792,0.753074705600739,0.76485013961792
|
193 |
+
"HyperAttentionDTI","Family","Seen Compound","Kinase",0.783226788043976,0.50566178560257,0.818425238132477,0.50566178560257
|
194 |
+
"DrugBAN","Family","Seen Target","Membrane Receptor",0.692588269710541,1.10425341129303,0.568347334861755,1.10425341129303
|
195 |
+
"DrugBAN","Family","Seen Compound","Membrane Receptor",0.750320196151733,0.99914276599884,0.70272022485733,0.99914276599884
|
196 |
+
"DrugBAN","Family","Unseen Target","Membrane Receptor",0.597703695297241,1.7254524230957,0.232900112867355,1.7254524230957
|
197 |
+
"DrugBAN","Family","Unseen Compound","Membrane Receptor",0.690906941890717,1.08922481536865,0.595273733139038,1.08922481536865
|
198 |
+
"DrugBAN","Family","Seen Target","Kinase",0.723353922367096,0.961626708507538,0.643972873687744,0.961626708507538
|
199 |
+
"DrugBAN","Family","Unseen Target","Kinase",0.620183289051056,1.29256415367126,0.488149046897888,1.29256415367126
|
200 |
+
"DrugBAN","Family","Unseen Compound","Kinase",0.704036116600037,1.05319464206696,0.625088930130005,1.05319464206696
|
201 |
+
"DrugBAN","Family","Seen Compound","Kinase",0.679675877094269,1.04449605941772,0.586575210094452,1.04449605941772
|
202 |
+
"DeepDTA","Family","Seen Target","Membrane Receptor",0.632937550544739,1.00777673721313,0.437225878238678,1.00777673721313
|
203 |
+
"DeepDTA","Family","Unseen Target","Membrane Receptor",0.569281041622162,1.54697322845459,0.184317737817764,1.54697322845459
|
204 |
+
"DeepDTA","Family","Seen Compound","Membrane Receptor",0.713543951511383,1.02762258052826,0.669277906417847,1.02762258052826
|
205 |
+
"DeepDTA","Family","Unseen Compound","Membrane Receptor",0.594201624393463,1.30646753311157,0.341125547885895,1.30646753311157
|
206 |
+
"DeepDTA","Family","Seen Target","Kinase",0.704596340656281,1.03138136863708,0.593095600605011,1.03138136863708
|
207 |
+
"DeepDTA","Family","Unseen Target","Kinase",0.615872144699097,1.60356402397156,0.31773716211319,1.60356402397156
|
208 |
+
"DeepDTA","Family","Seen Compound","Kinase",0.72610068321228,0.812425553798676,0.686115860939026,0.812425553798676
|
209 |
+
"DeepDTA","Family","Unseen Compound","Kinase",0.613347172737122,1.51863694190979,0.412139505147934,1.51863694190979
|
210 |
+
"MolTrans","Family","Seen Compound","Others",0.62357097864151,1.09521090984344,0.556737184524536,1.09521090984344
|
211 |
+
"MolTrans","Family","Seen Target","Others",0.678213775157928,0.930307328701019,0.577713489532471,0.930307328701019
|
212 |
+
"MolTrans","Family","Unseen Target","Others",0.52982234954834,1.7099701166153,0.0304255317896604,1.7099701166153
|
213 |
+
"MolTrans","Family","Unseen Compound","Others",0.586556315422058,0.901459097862244,0.639057040214539,0.901459097862244
|
214 |
+
"TransformerCPI","Family","Unseen Target","Others",0.554631531238556,1.48609471321106,0.183559030294418,1.48609471321106
|
215 |
+
"TransformerCPI","Family","Seen Target","Others",0.699329912662506,0.947890281677246,0.596725225448608,0.947890281677246
|
216 |
+
"TransformerCPI","Family","Seen Compound","Others",0.752355694770813,0.715793251991272,0.733081579208374,0.715793251991272
|
217 |
+
"TransformerCPI","Family","Unseen Compound","Others",0.684487998485565,0.693334341049194,0.737363278865814,0.693334341049194
|
218 |
+
"TransformerCPI","Family","Unseen Target","Nuclear Receptor",0.637928903102875,1.77168297767639,0.402463108301163,1.77168297767639
|
219 |
+
"TransformerCPI","Family","Seen Target","Nuclear Receptor",0.766366422176361,0.746203184127808,0.725264728069305,0.746203184127808
|
220 |
+
"TransformerCPI","Family","Seen Compound","Nuclear Receptor",0.739677131175995,0.695414423942566,0.726266622543335,0.695414423942566
|
221 |
+
"TransformerCPI","Family","Unseen Compound","Nuclear Receptor",0.693553805351257,0.93874317407608,0.612322807312012,0.93874317407608
|
222 |
+
"TransformerCPI","Family","Seen Target","Membrane Receptor",0.613319039344788,1.23189234733582,0.298088848590851,1.23189234733582
|
223 |
+
"TransformerCPI","Family","Unseen Target","Membrane Receptor",0.550589263439178,1.5799309015274,0.204689309000969,1.5799309015274
|
224 |
+
"TransformerCPI","Family","Seen Compound","Membrane Receptor",0.762694180011749,0.809340238571167,0.753226637840271,0.809340238571167
|
225 |
+
"TransformerCPI","Family","Unseen Compound","Membrane Receptor",0.638912796974182,1.00212979316711,0.534777700901031,1.00212979316711
|
226 |
+
"TransformerCPI","Family","Seen Target","Non-Kinase Enzyme",0.685823142528534,1.04233157634735,0.60007905960083,1.04233157634735
|
227 |
+
"TransformerCPI","Family","Unseen Target","Non-Kinase Enzyme",0.564606249332428,2.1840033531189,0.354994177818298,2.1840033531189
|
228 |
+
"TransformerCPI","Family","Unseen Compound","Non-Kinase Enzyme",0.725814044475555,0.88764762878418,0.733998537063599,0.88764762878418
|
229 |
+
"TransformerCPI","Family","Seen Compound","Non-Kinase Enzyme",0.750104069709778,0.801541686058044,0.745962858200073,0.801541686058044
|
230 |
+
"TransformerCPI","Family","Seen Target","Kinase",0.72637152671814,0.89704829454422,0.642249822616577,0.89704829454422
|
231 |
+
"TransformerCPI","Family","Unseen Target","Kinase",0.628425478935242,1.40067875385284,0.40097838640213,1.40067875385284
|
232 |
+
"TransformerCPI","Family","Seen Compound","Kinase",0.735091149806976,0.74647855758667,0.72381865978241,0.74647855758667
|
233 |
+
"TransformerCPI","Family","Unseen Compound","Kinase",0.721056044101715,0.922631800174713,0.680483758449554,0.922631800174713
|
234 |
+
"TransformerCPI2","Family","Unseen Target","Others",0.534898459911346,1.73679685592651,0.121087819337845,1.73679685592651
|
235 |
+
"TransformerCPI2","Family","Seen Target","Others",0.73077130317688,0.808882057666779,0.674387097358704,0.808882057666779
|
236 |
+
"TransformerCPI2","Family","Unseen Compound","Others",0.636097490787506,0.910576641559601,0.641943573951721,0.910576641559601
|
237 |
+
"TransformerCPI2","Family","Seen Compound","Others",0.718561410903931,0.609445929527283,0.775300085544586,0.609445929527283
|
238 |
+
"TransformerCPI2","Family","Seen Target","Nuclear Receptor",0.764660060405731,0.685606181621552,0.744019865989685,0.685606181621552
|
239 |
+
"TransformerCPI2","Family","Seen Compound","Nuclear Receptor",0.731884062290192,0.612749755382538,0.746593952178955,0.612749755382538
|
240 |
+
"TransformerCPI2","Family","Unseen Target","Nuclear Receptor",0.646949350833893,1.56016719341278,0.478035271167755,1.56016719341278
|
241 |
+
"TransformerCPI2","Family","Unseen Compound","Nuclear Receptor",0.69165426492691,0.765568435192108,0.691268384456635,0.765568435192108
|
242 |
+
"TransformerCPI2","Family","Seen Target","Membrane Receptor",0.615775525569916,1.52432131767273,0.269669622182846,1.52432131767273
|
243 |
+
"TransformerCPI2","Family","Unseen Target","Membrane Receptor",0.576914727687836,1.64949727058411,0.259859681129456,1.64949727058411
|
244 |
+
"TransformerCPI2","Family","Unseen Compound","Membrane Receptor",0.593285202980042,1.39671850204468,0.356591790914536,1.39671850204468
|
245 |
+
"TransformerCPI2","Family","Seen Compound","Membrane Receptor",0.746857821941376,0.733099043369293,0.782983124256134,0.733099043369293
|
246 |
+
"TransformerCPI2","Family","Seen Target","Non-Kinase Enzyme",0.734908282756805,0.824801504611969,0.707320272922516,0.824801504611969
|
247 |
+
"TransformerCPI2","Family","Unseen Target","Non-Kinase Enzyme",0.558393955230713,2.22074437141419,0.345216870307922,2.22074437141419
|
248 |
+
"TransformerCPI2","Family","Seen Compound","Non-Kinase Enzyme",0.741131663322449,0.663150429725647,0.789378106594086,0.663150429725647
|
249 |
+
"TransformerCPI2","Family","Unseen Compound","Non-Kinase Enzyme",0.663275063037872,0.975921750068665,0.697819232940674,0.975921750068665
|
250 |
+
"TransformerCPI2","Family","Unseen Target","Kinase",0.626501619815826,1.39530491828918,0.426643460988998,1.39530491828918
|
251 |
+
"TransformerCPI2","Family","Seen Target","Kinase",0.772497892379761,0.807334303855896,0.702603995800018,0.807334303855896
|
252 |
+
"TransformerCPI2","Family","Unseen Compound","Kinase",0.696166038513184,1.01691496372223,0.639800012111664,1.01691496372223
|
253 |
+
"TransformerCPI2","Family","Seen Compound","Kinase",0.709523320198059,0.661855638027191,0.755432665348053,0.661855638027191
|
254 |
+
"MGraphDTA","General","Seen Compound","Nuclear Receptor",0.824206292629242,0.59447306394577,0.751588225364685,0.59447306394577
|
255 |
+
"MGraphDTA","General","Unseen Compound","Nuclear Receptor",0.749779641628265,0.915948510169983,0.657572984695435,0.915948510169983
|
256 |
+
"MGraphDTA","General","Unseen Compound","Membrane Receptor",0.747370779514313,0.723451554775238,0.684935033321381,0.723451554775238
|
257 |
+
"MGraphDTA","General","Seen Compound","Membrane Receptor",0.815345883369446,0.596990942955017,0.830229878425598,0.596990942955017
|
258 |
+
"MGraphDTA","General","Unseen Compound","Kinase",0.768575727939606,0.635327339172363,0.798308551311493,0.635327339172363
|
259 |
+
"MGraphDTA","General","Seen Compound","Others",0.818475663661957,0.51272988319397,0.81409752368927,0.51272988319397
|
260 |
+
"MGraphDTA","General","Unseen Compound","Others",0.752516150474548,0.556287348270416,0.781966626644135,0.556287348270416
|
261 |
+
"MGraphDTA","General","Seen Compound","Kinase",0.793242275714874,0.515807032585144,0.816751420497894,0.515807032585144
|
262 |
+
"MGraphDTA","General","Seen Compound","Ion Channel",0.814500212669373,0.483192175626755,0.83148592710495,0.483192175626755
|
263 |
+
"MGraphDTA","General","Unseen Compound","Ion Channel",0.820433974266052,0.712914347648621,0.748995780944824,0.712914347648621
|
264 |
+
"MGraphDTA","General","Seen Target","Nuclear Receptor",0.800785899162292,0.471913188695908,0.804006218910217,0.471913188695908
|
265 |
+
"MGraphDTA","General","Unseen Target","Nuclear Receptor",0.613692760467529,2.31176090240479,0.339229673147201,2.31176090240479
|
266 |
+
"MGraphDTA","General","Seen Compound","Non-Kinase Enzyme",0.792026221752167,0.593307912349701,0.809937298297882,0.593307912349701
|
267 |
+
"MGraphDTA","General","Unseen Compound","Non-Kinase Enzyme",0.768222987651825,0.743701994419098,0.777636766433716,0.743701994419098
|
268 |
+
"MGraphDTA","General","Seen Target","Membrane Receptor",0.771976053714752,0.512748837471008,0.753793776035309,0.512748837471008
|
269 |
+
"MGraphDTA","General","Unseen Target","Membrane Receptor",0.583987832069397,1.70232141017914,0.280040711164474,1.70232141017914
|
270 |
+
"MGraphDTA","General","Unseen Target","Kinase",0.67606383562088,1.24524676799774,0.559893786907196,1.24524676799774
|
271 |
+
"MGraphDTA","General","Seen Target","Kinase",0.829383671283722,0.409139573574066,0.846226274967194,0.409139573574066
|
272 |
+
"MGraphDTA","General","Seen Target","Others",0.800189435482025,0.485200226306915,0.814346373081207,0.485200226306915
|
273 |
+
"MGraphDTA","General","Unseen Target","Others",0.598465442657471,1.62881374359131,0.182428807020187,1.62881374359131
|
274 |
+
"MGraphDTA","General","Seen Target","Non-Kinase Enzyme",0.810530364513397,0.479476690292358,0.830825567245483,0.479476690292358
|
275 |
+
"MGraphDTA","General","Unseen Target","Non-Kinase Enzyme",0.619406640529633,1.99528980255127,0.427087068557739,1.99528980255127
|
276 |
+
"MGraphDTA","General","Seen Target","Ion Channel",0.829020440578461,0.376539409160614,0.815297961235046,0.376539409160614
|
277 |
+
"MGraphDTA","General","Unseen Target","Ion Channel",0.672524511814117,1.03022921085358,0.436141490936279,1.03022921085358
|
278 |
+
"MGraphDTA","General","Seen Compound","All Families",0.800634384155273,0.559683561325073,0.828247547149658,0.559683561325073
|
279 |
+
"MGraphDTA","General","Unseen Compound","All Families",0.767934083938599,0.66819167137146,0.801590502262115,0.66819167137146
|
280 |
+
"MGraphDTA","General","Seen Target","All Families",0.795632600784302,0.468164891004562,0.824159204959869,0.468164891004562
|
281 |
+
"MGraphDTA","General","Unseen Target","All Families",0.629480481147766,1.63225710391998,0.420248121023178,1.63225710391998
|
282 |
+
"HyperAttentionDTI","General","Seen Compound","Nuclear Receptor",0.770164549350739,0.656516253948212,0.74196583032608,0.656516253948212
|
283 |
+
"HyperAttentionDTI","General","Unseen Compound","Nuclear Receptor",0.650158047676086,0.977805554866791,0.614107966423035,0.977805554866791
|
284 |
+
"HyperAttentionDTI","General","Seen Compound","Membrane Receptor",0.773928701877594,0.625320076942444,0.818581283092499,0.625320076942444
|
285 |
+
"HyperAttentionDTI","General","Unseen Compound","Membrane Receptor",0.669940292835236,0.864320039749146,0.629082262516022,0.864320039749146
|
286 |
+
"HyperAttentionDTI","General","Seen Compound","Kinase",0.76596736907959,0.556169867515564,0.799828231334686,0.556169867515564
|
287 |
+
"HyperAttentionDTI","General","Unseen Compound","Kinase",0.703913271427155,0.76980984210968,0.74417507648468,0.76980984210968
|
288 |
+
"HyperAttentionDTI","General","Seen Compound","Others",0.766018867492676,0.523591995239258,0.809544801712036,0.523591995239258
|
289 |
+
"HyperAttentionDTI","General","Unseen Compound","Others",0.657771229743958,0.720886409282684,0.719456315040588,0.720886409282684
|
290 |
+
"HyperAttentionDTI","General","Seen Compound","Ion Channel",0.765745282173157,0.567212522029877,0.79499614238739,0.567212522029877
|
291 |
+
"HyperAttentionDTI","General","Seen Compound","Non-Kinase Enzyme",0.753030598163605,0.657976567745209,0.791022300720215,0.657976567745209
|
292 |
+
"HyperAttentionDTI","General","Unseen Compound","Ion Channel",0.624701261520386,1.23171150684357,0.575183928012848,1.23171150684357
|
293 |
+
"HyperAttentionDTI","General","Seen Target","Nuclear Receptor",0.771817088127136,0.546984434127808,0.798151016235352,0.546984434127808
|
294 |
+
"HyperAttentionDTI","General","Unseen Target","Nuclear Receptor",0.598372459411621,1.73514151573181,0.454420387744904,1.73514151573181
|
295 |
+
"HyperAttentionDTI","General","Unseen Compound","Non-Kinase Enzyme",0.675931990146637,0.840552866458893,0.748816609382629,0.840552866458893
|
296 |
+
"HyperAttentionDTI","General","Seen Target","Membrane Receptor",0.754338145256042,0.56321120262146,0.738054394721985,0.56321120262146
|
297 |
+
"HyperAttentionDTI","General","Unseen Target","Others",0.595721483230591,1.47883498668671,0.206950038671494,1.47883498668671
|
298 |
+
"HyperAttentionDTI","General","Unseen Target","Membrane Receptor",0.592240333557129,1.69256246089935,0.285604804754257,1.69256246089935
|
299 |
+
"HyperAttentionDTI","General","Seen Target","Kinase",0.808814704418182,0.469862371683121,0.830349087715149,0.469862371683121
|
300 |
+
"HyperAttentionDTI","General","Unseen Target","Kinase",0.631613314151764,1.41089308261871,0.460201442241669,1.41089308261871
|
301 |
+
"HyperAttentionDTI","General","Seen Target","Others",0.776650011539459,0.506675064563751,0.797747254371643,0.506675064563751
|
302 |
+
"HyperAttentionDTI","General","Seen Target","Ion Channel",0.742332577705383,0.462633222341537,0.814903855323792,0.462633222341537
|
303 |
+
"HyperAttentionDTI","General","Unseen Target","Ion Channel",0.564681529998779,1.55633521080017,0.194632723927498,1.55633521080017
|
304 |
+
"HyperAttentionDTI","General","Seen Target","Non-Kinase Enzyme",0.77884715795517,0.550619661808014,0.80392587184906,0.550619661808014
|
305 |
+
"HyperAttentionDTI","General","Unseen Target","Non-Kinase Enzyme",0.57110184431076,2.28869485855103,0.321478992700577,2.28869485855103
|
306 |
+
"HyperAttentionDTI","General","Seen Target","All Families",0.780712127685547,0.522359371185303,0.804161131381989,0.522359371185303
|
307 |
+
"HyperAttentionDTI","General","Unseen Target","All Families",0.596790850162506,1.70128905773163,0.391337454319,1.70128905773163
|
308 |
+
"HyperAttentionDTI","General","Seen Compound","All Families",0.762095391750336,0.603128612041473,0.81469452381134,0.603128612041473
|
309 |
+
"HyperAttentionDTI","General","Unseen Compound","All Families",0.686023831367493,0.808506488800049,0.756600558757782,0.808506488800049
|
310 |
+
"GraphDTA","General","Seen Compound","Nuclear Receptor",0.69711446762085,1.30636298656464,0.333947539329529,1.30636298656464
|
311 |
+
"GraphDTA","General","Unseen Compound","Nuclear Receptor",0.605813324451447,1.04289245605469,0.535607993602753,1.04289245605469
|
312 |
+
"GraphDTA","General","Seen Compound","Membrane Receptor",0.674662411212921,1.3974437713623,0.545532643795013,1.3974437713623
|
313 |
+
"GraphDTA","General","Unseen Compound","Membrane Receptor",0.572210550308228,1.18426644802094,0.372938901185989,1.18426644802094
|
314 |
+
"GraphDTA","General","Seen Compound","Kinase",0.591393113136292,1.36200702190399,0.351521402597427,1.36200702190399
|
315 |
+
"GraphDTA","General","Unseen Compound","Kinase",0.583821773529053,1.58731639385223,0.306709319353104,1.58731639385223
|
316 |
+
"GraphDTA","General","Unseen Compound","Others",0.659901916980743,0.978016376495361,0.57583349943161,0.978016376495361
|
317 |
+
"GraphDTA","General","Seen Compound","Others",0.667223453521729,1.1772575378418,0.484364241361618,1.1772575378418
|
318 |
+
"GraphDTA","General","Seen Compound","Non-Kinase Enzyme",0.679523587226868,1.2651584148407,0.525422871112823,1.2651584148407
|
319 |
+
"GraphDTA","General","Unseen Compound","Ion Channel",0.815648555755615,1.28028786182404,0.524376392364502,1.28028786182404
|
320 |
+
"GraphDTA","General","Seen Compound","Ion Channel",0.620857536792755,1.14898312091827,0.516363024711609,1.14898312091827
|
321 |
+
"GraphDTA","General","Unseen Compound","Non-Kinase Enzyme",0.659335613250732,1.28573668003082,0.559330642223358,1.28573668003082
|
322 |
+
"GraphDTA","General","Unseen Target","Nuclear Receptor",0.605200290679932,2.38743042945862,0.281438380479813,2.38743042945862
|
323 |
+
"GraphDTA","General","Seen Target","Nuclear Receptor",0.55838006734848,1.27686488628387,0.397420644760132,1.27686488628387
|
324 |
+
"GraphDTA","General","Seen Target","Membrane Receptor",0.561867773532867,1.10598587989807,0.32837250828743,1.10598587989807
|
325 |
+
"GraphDTA","General","Seen Target","Kinase",0.608540534973145,1.41576385498047,0.342734038829803,1.41576385498047
|
326 |
+
"GraphDTA","General","Unseen Target","Membrane Receptor",0.524816691875458,1.48754775524139,0.0424380339682102,1.48754775524139
|
327 |
+
"GraphDTA","General","Unseen Target","Kinase",0.625947952270508,1.75586915016174,0.247443944215775,1.75586915016174
|
328 |
+
"GraphDTA","General","Seen Target","Others",0.533404111862183,1.28912103176117,0.284033298492432,1.28912103176117
|
329 |
+
"GraphDTA","General","Unseen Target","Others",0.597126603126526,1.13549888134003,0.225405469536781,1.13549888134003
|
330 |
+
"GraphDTA","General","Seen Target","Ion Channel",0.668115735054016,0.889194905757904,0.633068740367889,0.889194905757904
|
331 |
+
"GraphDTA","General","Seen Target","Non-Kinase Enzyme",0.573789179325104,1.40941751003265,0.360351234674454,1.40941751003265
|
332 |
+
"GraphDTA","General","Unseen Target","Non-Kinase Enzyme",0.539346575737,2.45953059196472,0.0718892961740493,2.45953059196472
|
333 |
+
"GraphDTA","General","Unseen Target","Ion Channel",0.630883157253265,1.05974054336548,0.388764381408691,1.05974054336548
|
334 |
+
"GraphDTA","General","Unseen Compound","All Families",0.623605191707611,1.2727245092392,0.55963921546936,1.2727245092392
|
335 |
+
"GraphDTA","General","Seen Compound","All Families",0.636456966400146,1.29452204704285,0.52912575006485,1.29452204704285
|
336 |
+
"GraphDTA","General","Seen Target","All Families",0.576442420482635,1.27394318580627,0.397183477878571,1.27394318580627
|
337 |
+
"GraphDTA","General","Unseen Target","All Families",0.581822872161865,1.71401977539062,0.237506628036499,1.71401977539062
|
338 |
+
"DrugVQA-Seq","General","Seen Compound","Nuclear Receptor",0.7127286195755,1.28417229652405,0.400030583143234,1.2936589717865
|
339 |
+
"DrugVQA-Seq","General","Unseen Compound","Nuclear Receptor",0.638574182987213,1.09442007541656,0.535453498363495,1.1039069890976
|
340 |
+
"DrugVQA-Seq","General","Seen Compound","Membrane Receptor",0.689547300338745,1.24990618228912,0.577249586582184,1.25939285755157
|
341 |
+
"DrugVQA-Seq","General","Unseen Compound","Membrane Receptor",0.61097264289856,1.23679709434509,0.376746237277985,1.24628388881683
|
342 |
+
"DrugVQA-Seq","General","Seen Compound","Kinase",0.629867434501648,1.22005450725555,0.463823229074478,1.22954154014587
|
343 |
+
"DrugVQA-Seq","General","Seen Compound","Others",0.666042327880859,1.13158476352692,0.498413294553757,1.14107167720795
|
344 |
+
"DrugVQA-Seq","General","Unseen Compound","Kinase",0.617111206054688,1.45791459083557,0.388726204633713,1.46740138530731
|
345 |
+
"DrugVQA-Seq","General","Unseen Compound","Others",0.627434015274048,1.04889214038849,0.57680481672287,1.05837905406952
|
346 |
+
"DrugVQA-Seq","General","Unseen Compound","Non-Kinase Enzyme",0.665546238422394,1.27120614051819,0.574960470199585,1.28069293498993
|
347 |
+
"DrugVQA-Seq","General","Seen Compound","Non-Kinase Enzyme",0.684292733669281,1.27051365375519,0.542270004749298,1.28000056743622
|
348 |
+
"DrugVQA-Seq","General","Seen Compound","Ion Channel",0.548999547958374,1.16439545154572,0.519590675830841,1.17388200759888
|
349 |
+
"DrugVQA-Seq","General","Unseen Compound","Ion Channel",0.817617952823639,1.06203234195709,0.610044240951538,1.07151913642883
|
350 |
+
"DrugVQA-Seq","General","Seen Target","Nuclear Receptor",0.591317296028137,1.28284895420074,0.471315950155258,1.29233574867249
|
351 |
+
"DrugVQA-Seq","General","Unseen Target","Nuclear Receptor",0.553655087947845,1.89911901950836,0.275895327329636,1.90860605239868
|
352 |
+
"DrugVQA-Seq","General","Seen Target","Membrane Receptor",0.619544804096222,1.02090573310852,0.418083876371384,1.03039264678955
|
353 |
+
"DrugVQA-Seq","General","Unseen Target","Membrane Receptor",0.599155962467194,1.48032784461975,0.198426380753517,1.48981475830078
|
354 |
+
"DrugVQA-Seq","General","Seen Target","Kinase",0.651884853839874,1.2429187297821,0.431624859571457,1.25240564346313
|
355 |
+
"DrugVQA-Seq","General","Seen Target","Others",0.592241942882538,1.18867146968842,0.38246887922287,1.19815838336945
|
356 |
+
"DrugVQA-Seq","General","Unseen Target","Kinase",0.656833052635193,1.43417990207672,0.455479115247726,1.44366669654846
|
357 |
+
"DrugVQA-Seq","General","Unseen Target","Others",0.639625787734985,2.02301073074341,0.160859763622284,2.03249764442444
|
358 |
+
"DrugVQA-Seq","General","Seen Target","Non-Kinase Enzyme",0.637554049491882,1.23483037948608,0.468178063631058,1.24431717395782
|
359 |
+
"DrugVQA-Seq","General","Unseen Target","Non-Kinase Enzyme",0.551453948020935,2.25430774688721,0.229580655694008,2.26379442214966
|
360 |
+
"DrugVQA-Seq","General","Seen Target","Ion Channel",0.68450540304184,0.855882406234741,0.634088814258575,0.865369200706482
|
361 |
+
"DrugVQA-Seq","General","Unseen Target","Ion Channel",0.644116520881653,1.33767139911652,0.264509975910187,1.34715807437897
|
362 |
+
"DrugVQA-Seq","General","Unseen Compound","All Families",0.647364139556885,1.23759615421295,0.584734380245209,1.24708306789398
|
363 |
+
"DrugVQA-Seq","General","Seen Compound","All Families",0.647955119609833,1.22153639793396,0.565743386745453,1.23102307319641
|
364 |
+
"DrugVQA-Seq","General","Seen Target","All Families",0.618397235870361,1.15648710727692,0.473122090101242,1.16597402095795
|
365 |
+
"DrugVQA-Seq","General","Unseen Target","All Families",0.595577597618103,1.72207581996918,0.321953862905502,1.73156237602234
|
366 |
+
"DrugBAN","General","Seen Compound","Nuclear Receptor",0.733298301696777,0.846541047096252,0.639691054821014,0.846541047096252
|
367 |
+
"DrugBAN","General","Unseen Compound","Nuclear Receptor",0.6848264336586,0.892114818096161,0.621175706386566,0.892114818096161
|
368 |
+
"DrugBAN","General","Seen Compound","Membrane Receptor",0.759339451789856,0.830854475498199,0.743227064609528,0.830854415893555
|
369 |
+
"DrugBAN","General","Unseen Compound","Membrane Receptor",0.683163940906525,0.88822478055954,0.604899168014526,0.88822478055954
|
370 |
+
"DrugBAN","General","Seen Compound","Kinase",0.706932306289673,0.960016906261444,0.629325807094574,0.960016906261444
|
371 |
+
"DrugBAN","General","Seen Compound","Others",0.739858090877533,0.811595499515533,0.680954098701477,0.811595499515533
|
372 |
+
"DrugBAN","General","Unseen Compound","Kinase",0.716298639774323,0.926006317138672,0.679528474807739,0.926006317138672
|
373 |
+
"DrugBAN","General","Unseen Compound","Others",0.683140397071838,0.705622553825378,0.716939806938171,0.705622553825378
|
374 |
+
"DrugBAN","General","Seen Compound","Ion Channel",0.72537750005722,0.860874652862549,0.666419446468353,0.860874652862549
|
375 |
+
"DrugBAN","General","Seen Compound","Non-Kinase Enzyme",0.734660863876343,0.853286027908325,0.712937295436859,0.853286027908325
|
376 |
+
"DrugBAN","General","Unseen Compound","Non-Kinase Enzyme",0.737567543983459,0.968757808208466,0.694825053215027,0.968757808208466
|
377 |
+
"DrugBAN","General","Unseen Compound","Ion Channel",0.660569548606873,0.988706469535828,0.615398526191711,0.988706469535828
|
378 |
+
"DrugBAN","General","Seen Target","Nuclear Receptor",0.7518270611763,0.815714478492737,0.679363489151001,0.815714478492737
|
379 |
+
"DrugBAN","General","Unseen Target","Nuclear Receptor",0.612266361713409,1.80272209644318,0.424185752868652,1.80272209644318
|
380 |
+
"DrugBAN","General","Seen Target","Membrane Receptor",0.704276144504547,0.759195625782013,0.634716391563416,0.759195625782013
|
381 |
+
"DrugBAN","General","Unseen Target","Membrane Receptor",0.56185382604599,1.67457723617554,0.2030860632658,1.67457723617554
|
382 |
+
"DrugBAN","General","Seen Target","Kinase",0.746905446052551,0.851984143257141,0.685960471630096,0.851984143257141
|
383 |
+
"DrugBAN","General","Unseen Target","Kinase",0.596762657165527,1.72698318958282,0.34327694773674,1.72698318958282
|
384 |
+
"DrugBAN","General","Seen Target","Others",0.727502584457397,0.726336538791656,0.689604818820953,0.726336538791656
|
385 |
+
"DrugBAN","General","Unseen Target","Others",0.5992711186409,1.19421553611755,0.254182696342468,1.19421553611755
|
386 |
+
"DrugBAN","General","Seen Target","Non-Kinase Enzyme",0.716082453727722,0.947138428688049,0.665507435798645,0.947138428688049
|
387 |
+
"DrugBAN","General","Seen Target","Ion Channel",0.657930433750153,0.68276834487915,0.702064573764801,0.68276834487915
|
388 |
+
"DrugBAN","General","Unseen Target","Non-Kinase Enzyme",0.582610428333282,2.14243388175964,0.289720863103867,2.14243388175964
|
389 |
+
"DrugBAN","General","Unseen Target","Ion Channel",0.529027819633484,1.30429220199585,0.22212278842926,1.30429220199585
|
390 |
+
"DrugBAN","General","Seen Target","All Families",0.720659613609314,0.811063289642334,0.683218419551849,0.811063289642334
|
391 |
+
"DrugBAN","General","Seen Compound","All Families",0.737507224082947,0.874348938465118,0.714894115924835,0.874348938465118
|
392 |
+
"DrugBAN","General","Unseen Compound","All Families",0.710345327854156,0.872481226921082,0.727037847042084,0.872481226921082
|
393 |
+
"DrugBAN","General","Unseen Target","All Families",0.593233108520508,1.67212200164795,0.323248326778412,1.67212200164795
|
394 |
+
"DeepConvDTI","General","Seen Compound","Nuclear Receptor",0.834348618984222,0.510429203510284,0.807105779647827,0.510429203510284
|
395 |
+
"DeepConvDTI","General","Unseen Compound","Nuclear Receptor",0.713836669921875,0.807272493839264,0.694427788257599,0.807272493839264
|
396 |
+
"DeepConvDTI","General","Seen Compound","Membrane Receptor",0.81273490190506,0.595894515514374,0.831708908081055,0.595894515514374
|
397 |
+
"DeepConvDTI","General","Unseen Compound","Membrane Receptor",0.745670258998871,0.800769031047821,0.685324370861053,0.800769031047821
|
398 |
+
"DeepConvDTI","General","Seen Compound","Kinase",0.821949541568756,0.480607450008392,0.830894887447357,0.480607450008392
|
399 |
+
"DeepConvDTI","General","Unseen Compound","Kinase",0.77647739648819,0.672096848487854,0.781244516372681,0.672096848487854
|
400 |
+
"DeepConvDTI","General","Seen Compound","Others",0.824258208274841,0.505321979522705,0.81899482011795,0.505321979522705
|
401 |
+
"DeepConvDTI","General","Unseen Compound","Others",0.720592260360718,0.6375452876091,0.763860046863556,0.6375452876091
|
402 |
+
"DeepConvDTI","General","Seen Compound","Non-Kinase Enzyme",0.79094934463501,0.609204173088074,0.808006465435028,0.609204173088074
|
403 |
+
"DeepConvDTI","General","Unseen Compound","Non-Kinase Enzyme",0.769006848335266,0.748645067214966,0.780113875865936,0.748645067214966
|
404 |
+
"DeepConvDTI","General","Seen Compound","Ion Channel",0.794400930404663,0.506487727165222,0.826787233352661,0.506487727165222
|
405 |
+
"DeepConvDTI","General","Unseen Compound","Ion Channel",0.822626829147339,0.754739820957184,0.742440581321716,0.754739820957184
|
406 |
+
"DeepConvDTI","General","Seen Target","Nuclear Receptor",0.808885514736176,0.472466558218002,0.835022509098053,0.472466558218002
|
407 |
+
"DeepConvDTI","General","Unseen Target","Nuclear Receptor",0.592839777469635,2.56651568412781,0.36336949467659,2.56651568412781
|
408 |
+
"DeepConvDTI","General","Seen Target","Membrane Receptor",0.77837598323822,0.522318363189697,0.767837107181549,0.522318363189697
|
409 |
+
"DeepConvDTI","General","Unseen Target","Membrane Receptor",0.566407203674316,2.22552490234375,0.196271926164627,2.22552490234375
|
410 |
+
"DeepConvDTI","General","Seen Target","Kinase",0.835858464241028,0.421911954879761,0.851726233959198,0.421911954879761
|
411 |
+
"DeepConvDTI","General","Seen Target","Others",0.796873092651367,0.49365022778511,0.809120833873749,0.49365022778511
|
412 |
+
"DeepConvDTI","General","Unseen Target","Kinase",0.676019668579102,1.44215381145477,0.548762857913971,1.44215381145477
|
413 |
+
"DeepConvDTI","General","Unseen Target","Others",0.596151113510132,1.60693335533142,0.230144113302231,1.60693335533142
|
414 |
+
"DeepConvDTI","General","Seen Target","Non-Kinase Enzyme",0.814036071300507,0.496216207742691,0.826280653476715,0.496216207742691
|
415 |
+
"DeepConvDTI","General","Unseen Target","Non-Kinase Enzyme",0.596422612667084,2.40928220748901,0.344726264476776,2.40928220748901
|
416 |
+
"DeepConvDTI","General","Seen Target","Ion Channel",0.829826176166534,0.41111096739769,0.836628377437592,0.41111096739769
|
417 |
+
"DeepConvDTI","General","Unseen Target","Ion Channel",0.60634458065033,1.68098711967468,0.279030323028564,1.68098711967468
|
418 |
+
"DeepConvDTI","General","Seen Compound","All Families",0.810697913169861,0.550425827503204,0.833214402198792,0.550425827503204
|
419 |
+
"DeepConvDTI","General","Unseen Compound","All Families",0.761145353317261,0.707843005657196,0.792497038841248,0.707843005657196
|
420 |
+
"DeepConvDTI","General","Seen Target","All Families",0.796083450317383,0.480400443077087,0.824145972728729,0.480400443077087
|
421 |
+
"DeepConvDTI","General","Unseen Target","All Families",0.605676472187042,1.93930125236511,0.397968530654907,1.93930125236511
|
422 |
+
"DeepDTA","General","Seen Compound","Nuclear Receptor",0.72253280878067,1.00279378890991,0.559007048606873,1.00279378890991
|
423 |
+
"DeepDTA","General","Unseen Compound","Nuclear Receptor",0.64173036813736,1.21305060386658,0.466040372848511,1.21305060386658
|
424 |
+
"DeepDTA","General","Seen Compound","Membrane Receptor",0.725550889968872,1.00812149047852,0.677877485752106,1.00812149047852
|
425 |
+
"DeepDTA","General","Unseen Compound","Membrane Receptor",0.60626208782196,1.18831121921539,0.415541142225266,1.18831121921539
|
426 |
+
"DeepDTA","General","Seen Compound","Kinase",0.719086408615112,0.85514497756958,0.662719130516052,0.85514497756958
|
427 |
+
"DeepDTA","General","Unseen Compound","Kinase",0.618511319160461,1.39889585971832,0.445148825645447,1.39889585971832
|
428 |
+
"DeepDTA","General","Seen Compound","Others",0.736108243465424,0.866848707199097,0.648767113685608,0.866848707199097
|
429 |
+
"DeepDTA","General","Unseen Compound","Others",0.661189019680023,0.898019134998322,0.633767127990723,0.898019134998322
|
430 |
+
"DeepDTA","General","Seen Compound","Non-Kinase Enzyme",0.727008402347565,1.0396671295166,0.651715874671936,1.0396671295166
|
431 |
+
"DeepDTA","General","Unseen Compound","Non-Kinase Enzyme",0.666577875614166,1.30335831642151,0.580670535564423,1.30335831642151
|
432 |
+
"DeepDTA","General","Seen Compound","Ion Channel",0.626151502132416,1.00586581230164,0.587419867515564,1.00586581230164
|
433 |
+
"DeepDTA","General","Unseen Compound","Ion Channel",0.825454592704773,0.978349387645721,0.6282599568367,0.978349387645721
|
434 |
+
"DeepDTA","General","Seen Target","Nuclear Receptor",0.672136127948761,1.14740061759949,0.528096616268158,1.14740061759949
|
435 |
+
"DeepDTA","General","Unseen Target","Nuclear Receptor",0.515969812870026,3.12213277816772,0.181447848677635,3.12213277816772
|
436 |
+
"DeepDTA","General","Seen Target","Membrane Receptor",0.641083180904388,0.939133048057556,0.483177572488785,0.939133048057556
|
437 |
+
"DeepDTA","General","Unseen Target","Membrane Receptor",0.56564474105835,1.62822902202606,0.147135674953461,1.62822902202606
|
438 |
+
"DeepDTA","General","Seen Target","Kinase",0.699309825897217,1.00590705871582,0.590151190757751,1.00590705871582
|
439 |
+
"DeepDTA","General","Unseen Target","Kinase",0.583334922790527,1.72105240821838,0.261178880929947,1.72105240821838
|
440 |
+
"DeepDTA","General","Seen Target","Others",0.641192495822906,1.00589883327484,0.530725300312042,1.00589883327484
|
441 |
+
"DeepDTA","General","Unseen Target","Others",0.571789443492889,1.22083938121796,0.147929772734642,1.22083938121796
|
442 |
+
"DeepDTA","General","Seen Target","Non-Kinase Enzyme",0.683396339416504,1.05863189697266,0.575212717056274,1.05863189697266
|
443 |
+
"DeepDTA","General","Unseen Target","Non-Kinase Enzyme",0.568826138973236,2.47397327423096,0.17560550570488,2.47397327423096
|
444 |
+
"DeepDTA","General","Seen Target","Ion Channel",0.737653136253357,0.719775915145874,0.680606007575989,0.719775915145874
|
445 |
+
"DeepDTA","General","Unseen Target","Ion Channel",0.57664030790329,1.11105740070343,0.267263770103455,1.11105740070343
|
446 |
+
"DeepDTA","General","Seen Compound","All Families",0.714931070804596,0.95200526714325,0.680707812309265,0.95200526714325
|
447 |
+
"DeepDTA","General","Unseen Compound","All Families",0.659297406673431,1.19523465633392,0.603320002555847,1.19523465633392
|
448 |
+
"DeepDTA","General","Seen Target","All Families",0.652947247028351,0.993563115596771,0.577321648597717,0.993563115596771
|
449 |
+
"DeepDTA","General","Unseen Target","All Families",0.58223682641983,1.81861591339111,0.243711709976196,1.81861591339111
|
450 |
+
"MolTrans","General","Seen Target","All Families",0.730839908123016,0.758949637413025,0.708580017089844,0.758949637413025
|
451 |
+
"MolTrans","General","Seen Compound","All Families",0.693377256393433,0.902661502361298,0.71853494644165,0.902661502361298
|
452 |
+
"MolTrans","General","Unseen Compound","All Families",0.632506370544434,0.999424695968628,0.696539878845215,0.999424695968628
|
453 |
+
"MolTrans","General","Unseen Target","All Families",0.559046506881714,1.89120042324066,0.275841027498245,1.89120042324066
|
454 |
+
"MolTrans","General","Seen Compound","Nuclear Receptor",0.701449275016785,0.755986869335175,0.686545014381409,0.755986869335175
|
455 |
+
"MolTrans","General","Unseen Compound","Nuclear Receptor",0.631556570529938,0.951582610607147,0.613294780254364,0.951582610607147
|
456 |
+
"MolTrans","General","Unseen Compound","Membrane Receptor",0.619805335998535,1.10751104354858,0.495111256837845,1.10751104354858
|
457 |
+
"MolTrans","General","Seen Compound","Membrane Receptor",0.717126846313477,0.953223884105682,0.725177466869354,0.953223884105682
|
458 |
+
"MolTrans","General","Seen Compound","Kinase",0.678643345832825,0.8991539478302,0.65538078546524,0.8991539478302
|
459 |
+
"MolTrans","General","Unseen Compound","Others",0.610201001167297,0.767151355743408,0.7096848487854,0.767151355743408
|
460 |
+
"MolTrans","General","Unseen Compound","Kinase",0.660596907138824,1.03934001922607,0.640881717205048,1.03934001922607
|
461 |
+
"MolTrans","General","Seen Compound","Ion Channel",0.693350255489349,0.754673004150391,0.722394406795502,0.754673004150391
|
462 |
+
"MolTrans","General","Seen Compound","Others",0.679848849773407,0.821610927581787,0.696057260036469,0.821610927581787
|
463 |
+
"MolTrans","General","Unseen Compound","Ion Channel",0.570931971073151,0.96358448266983,0.653166592121124,0.96358448266983
|
464 |
+
"MolTrans","General","Seen Target","Nuclear Receptor",0.736606299877167,0.746848464012146,0.71898365020752,0.746848464012146
|
465 |
+
"MolTrans","General","Unseen Target","Nuclear Receptor",0.593381583690643,1.78275811672211,0.409548729658127,1.78275811672211
|
466 |
+
"MolTrans","General","Unseen Compound","Non-Kinase Enzyme",0.619783997535706,1.11901867389679,0.660716831684113,1.11901867389679
|
467 |
+
"MolTrans","General","Seen Compound","Non-Kinase Enzyme",0.696210443973541,0.957946479320526,0.696228921413422,0.957946479320526
|
468 |
+
"MolTrans","General","Unseen Target","Membrane Receptor",0.551109969615936,2.03174734115601,0.15798944234848,2.03174734115601
|
469 |
+
"MolTrans","General","Seen Target","Kinase",0.75885671377182,0.719205737113953,0.726143479347229,0.719205737113953
|
470 |
+
"MolTrans","General","Seen Target","Membrane Receptor",0.709116995334625,0.799992501735687,0.629625499248505,0.799992501735687
|
471 |
+
"MolTrans","General","Unseen Target","Kinase",0.585846900939941,2.00441598892212,0.272965937852859,2.00441598892212
|
472 |
+
"MolTrans","General","Seen Target","Ion Channel",0.674463510513306,0.634892702102661,0.756968975067139,0.634892702102661
|
473 |
+
"MolTrans","General","Seen Target","Others",0.713937759399414,0.75469583272934,0.690617620944977,0.75469583272934
|
474 |
+
"MolTrans","General","Unseen Target","Others",0.537119269371033,1.40783822536469,0.132756277918816,1.40783822536469
|
475 |
+
"MolTrans","General","Unseen Target","Ion Channel",0.51028448343277,1.31309831142426,0.21708545088768,1.31309831142426
|
476 |
+
"MolTrans","General","Seen Target","Non-Kinase Enzyme",0.735654890537262,0.78357982635498,0.7118119597435,0.78357982635498
|
477 |
+
"MolTrans","General","Unseen Target","Non-Kinase Enzyme",0.533274114131927,2.18131303787231,0.296289205551147,2.18131303787231
|
478 |
+
"HyperAttentionDTI","Family","Seen Target","Non-Kinase Enzyme",0.826598465442657,0.46430429816246,0.832531690597534,0.46430429816246
|
479 |
+
"DeepConvDTI","Family","Seen Target","Non-Kinase Enzyme",0.831316113471985,0.440329909324646,0.839153409004211,0.440329879522324
|
480 |
+
"GraphDTA","Family","Seen Target","Non-Kinase Enzyme",0.597912073135376,1.32297706604004,0.35360386967659,1.32297706604004
|
481 |
+
"DrugBAN","Family","Seen Target","Non-Kinase Enzyme",0.758990168571472,0.953865826129913,0.676096618175507,0.953865766525269
|
482 |
+
"DeepDTA","Family","Seen Target","Non-Kinase Enzyme",0.708784699440002,1.01256453990936,0.515139400959015,1.01256453990936
|
483 |
+
"DrugVQA-Seq","Family","Seen Target","Non-Kinase Enzyme",0.680907785892487,1.31337225437164,0.459490239620209,1.32285916805267
|
484 |
+
"DrugVQA-Seq","Family","Unseen Target","Non-Kinase Enzyme",0.692651808261871,1.69394707679749,0.531503975391388,1.70343375205994
|
485 |
+
"HyperAttentionDTI","Family","Unseen Target","Non-Kinase Enzyme",0.637603998184204,2.00117802619934,0.47410249710083,2.00117802619934
|
486 |
+
"MGraphDTA","Family","Seen Target","Non-Kinase Enzyme",0.836955010890961,0.446788549423218,0.827885210514069,0.446788549423218
|
487 |
+
"GraphDTA","Family","Unseen Target","Non-Kinase Enzyme",0.529219210147858,2.37634015083313,0.0631745457649231,2.37634015083313
|
488 |
+
"DeepConvDTI","Family","Unseen Target","Non-Kinase Enzyme",0.602601408958435,2.57706069946289,0.34235206246376,2.57706069946289
|
489 |
+
"DrugBAN","Family","Unseen Target","Non-Kinase Enzyme",0.610384225845337,2.13919281959534,0.305289328098297,2.13919281959534
|
490 |
+
"DeepDTA","Family","Unseen Target","Non-Kinase Enzyme",0.557295143604279,2.33082985877991,0.261170595884323,2.33082985877991
|
491 |
+
"DeepConvDTI","Family","Seen Compound","Non-Kinase Enzyme",0.790204584598541,0.661864161491394,0.76468950510025,0.661864161491394
|
492 |
+
"DrugVQA-Seq","Family","Seen Compound","Non-Kinase Enzyme",0.676856398582458,1.36746180057526,0.485493123531341,1.376948595047
|
493 |
+
"HyperAttentionDTI","Family","Seen Compound","Non-Kinase Enzyme",0.779252350330353,0.722785830497742,0.773990035057068,0.722785830497742
|
494 |
+
"MGraphDTA","Family","Unseen Target","Non-Kinase Enzyme",0.647982716560364,1.79515695571899,0.521566569805145,1.79515695571899
|
495 |
+
"DeepDTA","Family","Seen Compound","Non-Kinase Enzyme",0.704517185688019,1.19808912277222,0.551978886127472,1.19808912277222
|
496 |
+
"GraphDTA","Family","Seen Compound","Non-Kinase Enzyme",0.665991008281708,1.38009357452393,0.495143353939056,1.38009357452393
|
497 |
+
"DrugBAN","Family","Seen Compound","Non-Kinase Enzyme",0.72874528169632,0.929172813892364,0.673461675643921,0.929172813892364
|
498 |
+
"HyperAttentionDTI","Family","Unseen Compound","Non-Kinase Enzyme",0.780009329319,0.743174374103546,0.77760523557663,0.743174374103546
|
499 |
+
"DeepDTA","Family","Unseen Compound","Non-Kinase Enzyme",0.686748743057251,1.34633576869965,0.576221108436584,1.34633576869965
|
500 |
+
"DeepConvDTI","Family","Unseen Compound","Non-Kinase Enzyme",0.782140552997589,0.751297116279602,0.756710708141327,0.751297116279602
|
501 |
+
"DrugVQA-Seq","Family","Unseen Compound","Non-Kinase Enzyme",0.685519099235535,1.45962333679199,0.567221283912659,1.46911025047302
|
502 |
+
"GraphDTA","Family","Unseen Compound","Non-Kinase Enzyme",0.693934619426727,1.30035614967346,0.535615801811218,1.30035614967346
|
503 |
+
"MGraphDTA","Family","Seen Compound","Non-Kinase Enzyme",0.778058230876923,0.73881733417511,0.780372321605682,0.73881733417511
|
504 |
+
"MGraphDTA","Family","Unseen Compound","Non-Kinase Enzyme",0.776960551738739,0.738119065761566,0.78425258398056,0.738119065761566
|
505 |
+
"DrugBAN","Family","Unseen Compound","Non-Kinase Enzyme",0.723466098308563,1.02601826190948,0.677564740180969,1.02601826190948
|
506 |
+
"DeepDTA","Family","Seen Target","Nuclear Receptor",0.692844808101654,1.04740929603577,0.547798991203308,1.04740929603577
|
507 |
+
"DrugVQA-Seq","Family","Seen Target","Nuclear Receptor",0.652852118015289,1.14137077331543,0.540649473667145,1.15085756778717
|
508 |
+
"DeepConvDTI","Family","Seen Target","Nuclear Receptor",0.769746959209442,0.845402717590332,0.811015248298645,0.845402717590332
|
509 |
+
"HyperAttentionDTI","Family","Seen Target","Nuclear Receptor",0.788171410560608,0.609327137470245,0.789701998233795,0.609327137470245
|
510 |
+
"DrugVQA-Seq","Family","Unseen Target","Nuclear Receptor",0.580026745796204,1.85767078399658,0.182532876729965,1.86715745925903
|
511 |
+
"GraphDTA","Family","Seen Target","Nuclear Receptor",0.630543231964111,1.19968748092651,0.630723297595978,1.19968748092651
|
512 |
+
"MGraphDTA","Family","Seen Target","Nuclear Receptor",0.782896518707275,0.657123625278473,0.727630376815796,0.657123625278473
|
513 |
+
"DrugBAN","Family","Seen Target","Nuclear Receptor",0.759499430656433,0.816183507442474,0.758934855461121,0.81618344783783
|
514 |
+
"DeepDTA","Family","Unseen Target","Nuclear Receptor",0.598305821418762,1.50425732135773,0.359252333641052,1.50425732135773
|
515 |
+
"HyperAttentionDTI","Family","Unseen Target","Nuclear Receptor",0.703477740287781,1.41236007213593,0.52192097902298,1.41236007213593
|
516 |
+
"DeepConvDTI","Family","Unseen Target","Nuclear Receptor",0.634195268154144,6.21439027786255,0.475829005241394,6.21439027786255
|
517 |
+
"DeepDTA","Family","Seen Compound","Nuclear Receptor",0.666957557201385,1.04402601718903,0.631213665008545,1.04402601718903
|
518 |
+
"DrugVQA-Seq","Family","Seen Compound","Nuclear Receptor",0.632049739360809,1.2066068649292,0.427762031555176,1.21609365940094
|
519 |
+
"GraphDTA","Family","Unseen Target","Nuclear Receptor",0.577351748943329,1.8760552406311,0.337671011686325,1.87605500221252
|
520 |
+
"MGraphDTA","Family","Unseen Target","Nuclear Receptor",0.62304949760437,1.58934032917023,0.515364766120911,1.58934032917023
|
521 |
+
"DrugBAN","Family","Unseen Target","Nuclear Receptor",0.632077574729919,1.61611807346344,0.460156619548798,1.61611807346344
|
522 |
+
"DeepConvDTI","Family","Seen Compound","Nuclear Receptor",0.817715704441071,1.2852418422699,0.780272960662842,1.28524172306061
|
523 |
+
"GraphDTA","Family","Seen Compound","Nuclear Receptor",0.6152503490448,1.23521649837494,0.459968149662018,1.23521649837494
|
524 |
+
"HyperAttentionDTI","Family","Seen Compound","Nuclear Receptor",0.838603436946869,0.60500556230545,0.793527543544769,0.60500556230545
|
525 |
+
"DeepDTA","Family","Unseen Compound","Nuclear Receptor",0.642651975154877,1.0630099773407,0.589535474777222,1.0630099773407
|
526 |
+
"DrugVQA-Seq","Family","Unseen Compound","Nuclear Receptor",0.718525588512421,0.977031350135803,0.652108669281006,0.986518263816834
|
527 |
+
"HyperAttentionDTI","Family","Unseen Compound","Nuclear Receptor",0.749475181102753,0.810584306716919,0.695766746997833,0.810584306716919
|
528 |
+
"MGraphDTA","Family","Seen Compound","Nuclear Receptor",0.756627023220062,1.04149889945984,0.677980780601501,1.04149889945984
|
529 |
+
"DrugBAN","Family","Seen Compound","Nuclear Receptor",0.768408417701721,0.851886987686157,0.657356441020966,0.851886987686157
|
530 |
+
"DeepConvDTI","Family","Unseen Compound","Nuclear Receptor",0.744016289710999,1.05573487281799,0.623393356800079,1.05573487281799
|
531 |
+
"GraphDTA","Family","Unseen Compound","Nuclear Receptor",0.721158444881439,0.895873725414276,0.778793573379517,0.895873725414276
|
532 |
+
"MGraphDTA","Family","Unseen Compound","Nuclear Receptor",0.745213031768799,0.90350741147995,0.733912765979767,0.90350741147995
|
533 |
+
"DrugBAN","Family","Unseen Compound","Nuclear Receptor",0.69710385799408,0.933992087841034,0.675451755523682,0.933992087841034
|
534 |
+
"DeepDTA","Family","Seen Target","Others",0.664370656013489,1.01558601856232,0.534892857074738,1.01558601856232
|
535 |
+
"DrugVQA-Seq","Family","Seen Target","Others",0.592857420444489,1.29472827911377,0.241617307066917,1.30421495437622
|
536 |
+
"GraphDTA","Family","Seen Target","Others",0.604087889194489,1.23728537559509,0.363847255706787,1.2372852563858
|
537 |
+
"MGraphDTA","Family","Seen Target","Others",0.816107034683228,0.504146695137024,0.761303901672363,0.504146695137024
|
538 |
+
"DeepDTA","Family","Unseen Target","Others",0.5466588139534,1.76080906391144,0.132275640964508,1.76080906391144
|
539 |
+
"HyperAttentionDTI","Family","Seen Target","Others",0.785217821598053,0.538744986057281,0.777295887470245,0.538744986057281
|
540 |
+
"DeepConvDTI","Family","Seen Target","Others",0.807047784328461,0.492782235145569,0.780859470367432,0.492782235145569
|
541 |
+
"DeepConvDTI","Family","Unseen Target","Others",0.554258406162262,2.65347266197205,0.19463075697422,2.65347266197205
|
542 |
+
"GraphDTA","Family","Unseen Target","Others",0.53229820728302,1.37599289417267,0.0594517849385738,1.37599289417267
|
543 |
+
"DrugVQA-Seq","Family","Unseen Target","Others",0.585442900657654,1.56899642944336,0.108237572014332,1.57848334312439
|
544 |
+
"MGraphDTA","Family","Unseen Target","Others",0.589806079864502,1.74205756187439,0.121755301952362,1.74205780029297
|
545 |
+
"DrugBAN","Family","Seen Target","Others",0.746952891349792,0.719278514385223,0.674187541007996,0.719278514385223
|
546 |
+
"DeepDTA","Family","Seen Compound","Others",0.755290865898132,0.897148609161377,0.607144892215729,0.897148609161377
|
547 |
+
"DrugVQA-Seq","Family","Seen Compound","Others",0.679776310920715,1.28913915157318,0.512191534042358,1.29862606525421
|
548 |
+
"HyperAttentionDTI","Family","Unseen Target","Others",0.567255556583405,1.54557931423187,0.186336845159531,1.54557931423187
|
549 |
+
"DeepConvDTI","Family","Seen Compound","Others",0.821499705314636,0.524767577648163,0.78709489107132,0.524767577648163
|
550 |
+
"GraphDTA","Family","Seen Compound","Others",0.705234885215759,1.08321487903595,0.479119390249252,1.08321487903595
|
551 |
+
"MGraphDTA","Family","Seen Compound","Others",0.808635592460632,0.537768602371216,0.812568843364716,0.537768602371216
|
552 |
+
"DrugBAN","Family","Seen Compound","Others",0.754056572914124,0.780141294002533,0.702757000923157,0.780141294002533
|
553 |
+
"DrugBAN","Family","Unseen Target","Others",0.553932964801788,1.51689481735229,0.148411080241203,1.51689481735229
|
554 |
+
"DeepDTA","Family","Unseen Compound","Others",0.713139116764069,1.02664613723755,0.63239574432373,1.02664613723755
|
555 |
+
"HyperAttentionDTI","Family","Seen Compound","Others",0.804645895957947,0.566227912902832,0.78702574968338,0.566227912902832
|
556 |
+
"DrugVQA-Seq","Family","Unseen Compound","Others",0.724934101104736,1.10332095623016,0.574185311794281,1.1128077507019
|
557 |
+
"GraphDTA","Family","Unseen Compound","Others",0.73177695274353,0.890468180179596,0.612435400485992,0.890468180179596
|
558 |
+
"MGraphDTA","Family","Unseen Compound","Others",0.782005250453949,0.584915280342102,0.832952618598938,0.584915280342102
|
559 |
+
"HyperAttentionDTI","Family","Unseen Compound","Others",0.763213515281677,0.781023442745209,0.707260727882385,0.781023442745209
|
560 |
+
"DeepConvDTI","Family","Unseen Compound","Others",0.79063606262207,0.599399507045746,0.773636758327484,0.599399507045746
|
561 |
+
"DrugBAN","Family","Unseen Compound","Others",0.774069607257843,0.639412701129913,0.759598195552826,0.639412701129913
|
562 |
+
"DeepDTA","Family","Seen Target","Ion Channel",0.7490074634552,0.590129494667053,0.767654240131378,0.590129494667053
|
563 |
+
"DrugVQA-Seq","Family","Seen Target","Ion Channel",0.678660035133362,0.69475245475769,0.760382115840912,0.704239308834076
|
564 |
+
"DeepConvDTI","Family","Seen Target","Ion Channel",0.830272972583771,0.317345082759857,0.931784212589264,0.317345082759857
|
565 |
+
"GraphDTA","Family","Seen Target","Ion Channel",0.66823822259903,0.742598235607147,0.6362184882164,0.742598235607147
|
566 |
+
"HyperAttentionDTI","Family","Unseen Target","Ion Channel",0.582516968250275,1.53865563869476,0.267396837472916,1.53865563869476
|
567 |
+
"MGraphDTA","Family","Seen Target","Ion Channel",0.845037221908569,0.313198894262314,0.835587322711945,0.313198924064636
|
568 |
+
"HyperAttentionDTI","Family","Seen Target","Ion Channel",0.814540088176727,0.370823860168457,0.846137881278992,0.370823860168457
|
569 |
+
"DrugBAN","Family","Seen Target","Ion Channel",0.763027310371399,0.595031440258026,0.717684626579285,0.595031440258026
|
570 |
+
"DeepDTA","Family","Unseen Target","Ion Channel",0.60961639881134,1.14475679397583,0.467122614383698,1.14475679397583
|
571 |
+
"DeepDTA","Family","Seen Compound","Ion Channel",0.672486782073975,1.07949614524841,0.544958233833313,1.07949614524841
|
572 |
+
"DrugVQA-Seq","Family","Unseen Target","Ion Channel",0.522960543632507,1.27336251735687,0.0103728994727134,1.28284931182861
|
573 |
+
"DeepConvDTI","Family","Unseen Target","Ion Channel",0.627012431621552,2.86244702339172,0.403086096048355,2.86244702339172
|
574 |
+
"GraphDTA","Family","Unseen Target","Ion Channel",0.603349566459656,1.71641802787781,0.387210577726364,1.71641802787781
|
575 |
+
"HyperAttentionDTI","Family","Seen Compound","Ion Channel",0.794406652450562,0.602601230144501,0.767857134342194,0.602601230144501
|
576 |
+
"MGraphDTA","Family","Unseen Target","Ion Channel",0.521988093852997,1.8670734167099,0.218093931674957,1.8670734167099
|
577 |
+
"DrugBAN","Family","Unseen Target","Ion Channel",0.515613198280334,1.35039818286896,-0.0875587537884712,1.35039818286896
|
578 |
+
"DeepDTA","Family","Unseen Compound","Ion Channel",0.665066659450531,1.09767746925354,0.529113471508026,1.09767746925354
|
579 |
+
"DrugVQA-Seq","Family","Seen Compound","Ion Channel",0.626349210739136,1.22135353088379,0.450686812400818,1.23084044456482
|
580 |
+
"DeepConvDTI","Family","Seen Compound","Ion Channel",0.80910050868988,0.634097456932068,0.719262421131134,0.634097456932068
|
581 |
+
"GraphDTA","Family","Seen Compound","Ion Channel",0.612804234027863,1.31919813156128,0.404249966144562,1.31919813156128
|
582 |
+
"HyperAttentionDTI","Family","Unseen Compound","Ion Channel",0.703566133975983,1.02407121658325,0.564395785331726,1.02407121658325
|
583 |
+
"MGraphDTA","Family","Seen Compound","Ion Channel",0.821798920631409,0.543450772762299,0.835208237171173,0.543450832366943
|
584 |
+
"DrugBAN","Family","Unseen Compound","Ion Channel",0.745599985122681,0.996490776538849,0.605574548244476,0.996490776538849
|
585 |
+
"DrugBAN","Family","Seen Compound","Ion Channel",0.730158746242523,0.91983288526535,0.707583487033844,0.91983288526535
|
586 |
+
"DrugVQA-Seq","Family","Unseen Compound","Ion Channel",0.692480027675629,0.982177555561066,0.460112899541855,0.991664469242096
|
587 |
+
"DeepConvDTI","Family","Unseen Compound","Ion Channel",0.811626672744751,0.543934762477875,0.763084232807159,0.54393482208252
|
588 |
+
"MGraphDTA","Family","Unseen Compound","Ion Channel",0.774186670780182,0.606881022453308,0.748690009117126,0.606881022453308
|
589 |
+
"GraphDTA","Family","Unseen Compound","Ion Channel",0.675093352794647,0.970656752586365,0.567092180252075,0.970656752586365
|
590 |
+
"TransformerCPI2","General","Random Split","All Families",0.698099493980408,0.880392491817474,0.732315957546234,0.880392491817474
|
591 |
+
"TransformerCPI","General","Random Split","All Families",0.657836973667145,1.17864060401917,0.625967860221863,1.17864060401917
|
data/benchmarks/DTI_test_metrics.csv
ADDED
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|
|