molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL388978 |
|
IC50 |
= |
13.9 |
nM |
466.54 |
CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 |
Homo sapiens |
CHEMBL4328501 |
single protein format |
CHEMBL3774448 |
OBDepict
S
N
H
S
O
N
|
IC50 |
= |
157.0 |
nM |
272.35 |
O=C1NC(=S)S/C1=Cc1ccc2ncccc2c1 |
Homo sapiens |
CHEMBL3776317 |
assay format |
CHEMBL2171124 |
OBDepict
O
N
F
F
F
N
CH
3
H
2
N
N
N
|
IC50 |
= |
701.0 |
nM |
451.45 |
Cn1cc(-c2ccc3c(c2)CCN3C(=O)Cc2cccc(C(F)(F)F)c2)c2c(N)ncnc21 |
Homo sapiens |
CHEMBL2172943 |
single protein format |