ligand
stringlengths 7
13
| protein
stringclasses 7
values | score
float64 -30.2
3.17k
|
|---|---|---|
CHEMBL121406
|
tyk2
| -6.908
|
CHEMBL1683388
|
ankh
| -6.979
|
CHEMBL3133276
|
tyk2
| -6.207
|
CHEMBL2316895
|
cfhr5
| -6.957
|
CHEMBL3673443
|
nlrp3
| -8.82
|
CHEMBL3781404
|
map3k15
| -6.743
|
CHEMBL1377904
|
slc30a8
| -7.379
|
CHEMBL246166
|
ankh
| -6.413
|
CHEMBL125211
|
tyk2
| -7.215
|
CHEMBL4855922
|
slc30a8
| -7.301
|
CHEMBL1589091
|
nlrp3
| -7.985
|
CHEMBL1766367
|
nlrp3
| -7.199
|
CHEMBL3092850
|
ankh
| -7.269
|
CHEMBL1722286
|
adcy5
| -7.232
|
CHEMBL3975987
|
slc30a8
| -8.54
|
CHEMBL520395
|
slc30a8
| -5.448
|
CHEMBL2112288
|
tyk2
| -5.005
|
CHEMBL4594860
|
cfhr5
| -9.255
|
CHEMBL1979573
|
ankh
| -5.718
|
CHEMBL1363422
|
tyk2
| -8.597
|
CHEMBL517066
|
nlrp3
| -6.629
|
CHEMBL3763510
|
slc30a8
| -4.625
|
CHEMBL1317044
|
map3k15
| -6.571
|
CHEMBL1473841
|
slc30a8
| -6.905
|
CHEMBL3901060
|
slc30a8
| -8.429
|
CHEMBL212088
|
nlrp3
| -7.348
|
CHEMBL1461198
|
ankh
| -6.481
|
CHEMBL135064
|
ankh
| -4.98
|
CHEMBL197238
|
adcy5
| -7.385
|
CHEMBL2437382
|
nlrp3
| -7.521
|
CHEMBL1181803
|
slc30a8
| -6.732
|
CHEMBL2397971
|
tyk2
| -6.934
|
CHEMBL247735
|
cfhr5
| -5.015
|
CHEMBL1597283
|
map3k15
| -7.333
|
CHEMBL1970568
|
slc30a8
| -6.979
|
CHEMBL445120
|
map3k15
| -6.693
|
CHEMBL2221155
|
ankh
| -6.636
|
CHEMBL1618242
|
nlrp3
| -7.445
|
CHEMBL5026829
|
adcy5
| -8.13
|
CHEMBL64439
|
slc30a8
| -6.831
|
CHEMBL2031764
|
cfhr5
| -6.225
|
CHEMBL186079
|
tyk2
| -7.11
|
CHEMBL4208109
|
cfhr5
| -6.565
|
CHEMBL1830907
|
map3k15
| -7.134
|
CHEMBL1375651
|
slc30a8
| -7.474
|
CHEMBL3556924
|
adcy5
| -6.765
|
CHEMBL1784709
|
adcy5
| -7.45
|
CHEMBL3696690
|
slc30a8
| -7.455
|
CHEMBL435156
|
nlrp3
| -7.132
|
CHEMBL128049
|
map3k15
| -7.003
|
CHEMBL93448
|
tyk2
| -7.109
|
CHEMBL3945233
|
ankh
| -7.044
|
CHEMBL1923177
|
ankh
| -6.006
|
CHEMBL2272625
|
tyk2
| -6.596
|
CHEMBL1423464
|
ankh
| -5.31
|
CHEMBL8783
|
cfhr5
| -6.85
|
CHEMBL4876459
|
slc30a8
| -8.171
|
CHEMBL1487832
|
nlrp3
| -7.436
|
CHEMBL1957595
|
cfhr5
| -6.921
|
CHEMBL3502297
|
adcy5
| -10.33
|
CHEMBL1538193
|
nlrp3
| -8.391
|
CHEMBL4912877
|
tyk2
| -6.773
|
CHEMBL3957167
|
cfhr5
| -5.085
|
CHEMBL119592
|
nlrp3
| -8.115
|
CHEMBL4594183
|
map3k15
| -5.771
|
CHEMBL1914895
|
slc30a8
| -7.254
|
CHEMBL3488333
|
tyk2
| -6.452
|
CHEMBL611518
|
nlrp3
| -7.618
|
CHEMBL516412
|
ankh
| -4.755
|
CHEMBL4459364
|
nlrp3
| -6.904
|
CHEMBL3189073
|
adcy5
| -4.367
|
CHEMBL241172
|
adcy5
| -7.272
|
CHEMBL379740
|
slc30a8
| -8.44
|
CHEMBL3437123
|
map3k15
| -6.52
|
CHEMBL2449313
|
adcy5
| -4.28
|
CHEMBL4216133
|
cfhr5
| -5.448
|
CHEMBL1455976
|
cfhr5
| -4.738
|
CHEMBL402725
|
adcy5
| -6.188
|
CHEMBL4227245
|
map3k15
| -8.356
|
CHEMBL14789
|
nlrp3
| -8.773
|
CHEMBL3493725
|
map3k15
| -6.516
|
CHEMBL4073998
|
adcy5
| -1.144
|
CHEMBL3183290
|
map3k15
| -7.742
|
CHEMBL2436438
|
map3k15
| -7.956
|
CHEMBL1905757
|
slc30a8
| -6.393
|
CHEMBL215941
|
map3k15
| -8.126
|
CHEMBL3126743
|
tyk2
| -5.755
|
CHEMBL3442478
|
nlrp3
| -7.858
|
CHEMBL474683
|
tyk2
| -7.134
|
CHEMBL431114
|
cfhr5
| -7.435
|
CHEMBL3461062
|
nlrp3
| -6.949
|
CHEMBL4566237
|
ankh
| -5.308
|
CHEMBL3955588
|
cfhr5
| -5.377
|
CHEMBL3472965
|
tyk2
| -7.454
|
CHEMBL3304083
|
nlrp3
| -5.284
|
CHEMBL3989034
|
ankh
| -5.925
|
CHEMBL1410501
|
slc30a8
| -6.786
|
CHEMBL108318
|
adcy5
| -4.838
|
CHEMBL1533186
|
tyk2
| -6.251
|
CHEMBL3326791
|
cfhr5
| -6.707
|
Subsets and Splits
Filter SCN10A Protein Data
Retrieves all records from the test dataset where the protein is 'scn10a', providing a basic filter on the data.
Validation Data for SCN10A
Retrieves all records from the validation dataset where the protein is 'scn10a', providing a basic filter but limited analytical value.
Filter SCN10A Protein Data
Retrieves all records from the train dataset where the protein is 'scn10a', providing a basic filter but limited analytical value.