Datasets:
Dataset Viewer
ligand
stringlengths 7
13
| protein
stringclasses 7
values | score
float64 -30.2
3.17k
|
|---|---|---|
CHEMBL3666759
|
nlrp3
| -8.458
|
CHEMBL5178681
|
adcy5
| -5.862
|
CHEMBL1449210
|
map3k15
| -7.79
|
CHEMBL4528842
|
cfhr5
| -5.536
|
CHEMBL4942707
|
map3k15
| -6.297
|
CHEMBL4573764
|
tyk2
| -6.416
|
CHEMBL184343
|
ankh
| -6.304
|
CHEMBL3187960
|
tyk2
| -4.638
|
CHEMBL1951613
|
adcy5
| -0.785
|
CHEMBL5084277
|
nlrp3
| -8.073
|
CHEMBL285962
|
slc30a8
| -6.215
|
CHEMBL3981701
|
adcy5
| -7.121
|
CHEMBL103957
|
map3k15
| -7.054
|
CHEMBL1367680
|
tyk2
| -4.142
|
CHEMBL3691333
|
ankh
| -6.878
|
CHEMBL1871173
|
tyk2
| -8.699
|
CHEMBL36182
|
adcy5
| -6.4
|
CHEMBL2107002
|
tyk2
| -4.606
|
CHEMBL199434
|
cfhr5
| -6.462
|
CHEMBL4959929
|
map3k15
| -7.516
|
CHEMBL3185151
|
slc30a8
| -7.372
|
CHEMBL1592918
|
slc30a8
| -5.837
|
CHEMBL1300062
|
adcy5
| -8.079
|
CHEMBL3289116
|
nlrp3
| -8.519
|
CHEMBL4093023
|
cfhr5
| -9.204
|
CHEMBL1672339
|
adcy5
| -5.824
|
CHEMBL54883
|
map3k15
| -5.975
|
CHEMBL1500646
|
ankh
| -4.959
|
CHEMBL562549
|
slc30a8
| -7.44
|
CHEMBL1566424
|
map3k15
| -8.585
|
CHEMBL4877739
|
slc30a8
| -7.875
|
CHEMBL1892328
|
tyk2
| -7.473
|
CHEMBL5087804
|
tyk2
| -8.051
|
CHEMBL2068746
|
adcy5
| -7.009
|
CHEMBL4763467
|
nlrp3
| -11.058
|
CHEMBL4471944
|
map3k15
| -7.606
|
CHEMBL325780
|
slc30a8
| -7.46
|
CHEMBL1989861
|
nlrp3
| -8.291
|
CHEMBL3445846
|
adcy5
| -7.437
|
CHEMBL1613252
|
ankh
| -5.473
|
CHEMBL3291076
|
map3k15
| -7.081
|
CHEMBL3936122
|
map3k15
| -7.188
|
CHEMBL1545994
|
map3k15
| -7.259
|
CHEMBL4558481
|
adcy5
| -9.159
|
CHEMBL4741736
|
adcy5
| 0.996
|
CHEMBL4762873
|
nlrp3
| -9.366
|
CHEMBL1790926
|
slc30a8
| -6.084
|
CHEMBL3775455
|
ankh
| -6.464
|
CHEMBL4782547
|
tyk2
| -7.381
|
CHEMBL4776698
|
cfhr5
| -6.148
|
CHEMBL4636174
|
adcy5
| -8.217
|
CHEMBL4588123
|
ankh
| -6.641
|
CHEMBL4531981
|
adcy5
| -6.728
|
CHEMBL139640
|
tyk2
| -7.426
|
CHEMBL327672
|
map3k15
| -6.857
|
CHEMBL1968694
|
nlrp3
| -7.098
|
CHEMBL4764034
|
tyk2
| -3.945
|
CHEMBL1876722
|
map3k15
| -9.659
|
CHEMBL3463701
|
tyk2
| -5.297
|
CHEMBL1513110
|
map3k15
| -7.618
|
CHEMBL179073
|
cfhr5
| -6.529
|
CHEMBL32862
|
cfhr5
| -6.076
|
CHEMBL4750584
|
map3k15
| -7.17
|
CHEMBL2380486
|
cfhr5
| -6.442
|
CHEMBL1830861
|
slc30a8
| -7.149
|
CHEMBL1430941
|
ankh
| -5.94
|
CHEMBL3470904
|
map3k15
| -6.301
|
CHEMBL4940195
|
nlrp3
| -6.884
|
CHEMBL131690
|
slc30a8
| -8.035
|
CHEMBL3286461
|
ankh
| -6.48
|
CHEMBL1434454
|
tyk2
| -7.137
|
CHEMBL1428619
|
cfhr5
| -6.122
|
CHEMBL3127807
|
tyk2
| -8.161
|
CHEMBL1585029
|
map3k15
| -6.234
|
CHEMBL2381561
|
nlrp3
| -8.184
|
CHEMBL4079077
|
adcy5
| 7.99
|
CHEMBL4932724
|
ankh
| -6.785
|
CHEMBL1461296
|
cfhr5
| -6.122
|
CHEMBL3906840
|
ankh
| -7.263
|
CHEMBL1330267
|
slc30a8
| -7
|
CHEMBL1669698
|
map3k15
| -6.6
|
CHEMBL4900525
|
ankh
| -6.43
|
CHEMBL4297378
|
tyk2
| -5.169
|
CHEMBL97841
|
adcy5
| -6.13
|
CHEMBL1310090
|
map3k15
| -7.716
|
CHEMBL4279897
|
map3k15
| -7.827
|
CHEMBL1405306
|
cfhr5
| -6.872
|
CHEMBL3218452
|
ankh
| -4.825
|
CHEMBL117408
|
adcy5
| -6.438
|
CHEMBL1300677
|
nlrp3
| -6.847
|
CHEMBL466356
|
map3k15
| -6.552
|
CHEMBL4966513
|
ankh
| -6.07
|
CHEMBL4214634
|
nlrp3
| -8.183
|
CHEMBL2362910
|
adcy5
| -1.686
|
CHEMBL1719453
|
slc30a8
| -8.637
|
CHEMBL4929723
|
slc30a8
| -5.596
|
CHEMBL1526806
|
ankh
| -6.383
|
CHEMBL1995765
|
adcy5
| -6.143
|
CHEMBL3139505
|
nlrp3
| -6.927
|
CHEMBL4291131
|
slc30a8
| -7.022
|
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