molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL51085 |
|
IC50 |
= |
42.0 |
nM |
274.18 |
O=c1c2ccccc2[se]n1-c1ccccc1 |
Homo sapiens |
CHEMBL4399071 |
cell-based format |
CHEMBL4241044 |
OBDepict
HO
N
H
O
N
H
N
N
N
H
O
F
|
IC50 |
= |
56.0 |
nM |
447.47 |
O=C(C[C@@H](Cc1ccc2ccccc2c1)n1cc(CNC(=O)c2ccc(F)cc2)nn1)NO |
Homo sapiens |
CHEMBL4232680 |
single protein format |
CHEMBL4527561 |
OBDepict
HO
N
H
O
N
H
NH
N
H
N
H
O
F
|
IC50 |
= |
56.0 |
nM |
449.49 |
O=C(C[C@@H](Cc1ccc2ccccc2c1)N1C=C(CNC(=O)c2ccc(F)cc2)NN1)NO |
Homo sapiens |
CHEMBL4357319 |
single protein format |
CHEMBL3235416 |
OBDepict
CH
3
NH
O
NH
H
N
O
N
N
H
O
HO
|
IC50 |
= |
100.0 |
nM |
401.47 |
CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN(CCCc1ccccc1)CC(=O)O |
Homo sapiens |
CHEMBL3243737 |
single protein format |
CHEMBL3235414 |
OBDepict
CH
3
O
O
NH
H
N
O
N
N
H
O
HO
|
IC50 |
= |
600.0 |
nM |
402.45 |
COC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN(CCCc1ccccc1)CC(=O)O |
Homo sapiens |
CHEMBL3243737 |
single protein format |
CHEMBL3235415 |
OBDepict
CH
3
NH
O
NH
H
N
O
N
N
H
O
OH
|
IC50 |
= |
600.0 |
nM |
373.41 |
CNC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CN(CC(=O)O)Cc1ccccc1 |
Homo sapiens |
CHEMBL3243737 |
single protein format |