molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL4586347 |
|
IC50 |
= |
330.0 |
nM |
504.61 |
O=C(CSc1nc2ccc(N3CCOCC3)cc2c(=O)n1CCc1ccccc1)NCc1ccco1 |
Homo sapiens |
CHEMBL4356418 |
cell-based format |
CHEMBL4104719 |
OBDepict
O
HN
N
S
N
S
N
NH
O
N
|
IC50 |
= |
500.0 |
nM |
588.72 |
O=C(NCc1ccncc1)c1cnc2c(SSc3cccc4cc(C(=O)NCc5ccncc5)cnc34)cccc2c1 |
Homo sapiens |
CHEMBL4049711 |
single protein format |
CHEMBL4095913 |
OBDepict
O
NH
N
O
S
S
N
HN
O
O
|
IC50 |
= |
900.0 |
nM |
566.66 |
O=C(NCc1ccco1)c1cnc2c(SSc3cccc4cc(C(=O)NCc5ccco5)cnc34)cccc2c1 |
Homo sapiens |
CHEMBL4049711 |
single protein format |