molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL4445621 |
|
IC50 |
= |
52.0 |
nM |
256.29 |
N=C1C(=O)NC(=O)c2cc(-c3ccccc3)sc21 |
Homo sapiens |
CHEMBL4434553 |
assay format |
CHEMBL3393171 |
OBDepict
NH
2
N
S
H
O
|
IC50 |
= |
277.0 |
nM |
242.3 |
Nc1c[nH]c(=O)c2cc(-c3ccccc3)sc12 |
Homo sapiens |
CHEMBL3395568 |
assay format |
CHEMBL55 |
OBDepict
NH
2
NH
O
O
NH
NH
2
|
IC50 |
= |
300.0 |
nM |
340.43 |
N=C(N)c1ccc(OCCCCCOc2ccc(C(=N)N)cc2)cc1 |
Homo sapiens |
CHEMBL4434546 |
single protein format |
CHEMBL1088572 |
OBDepict
F
N
H
O
P
O
OH
_
O
O
O
+
Na
|
IC50 |
= |
314.0 |
nM |
387.24 |
O=P([O-])(O)OC1C=C(c2ccccc2F)Nc2cc3c(cc21)OCO3.[Na+] |
Homo sapiens |
CHEMBL1113393 |
single protein format |