molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL3218297 |
|
IC50 |
= |
34.06 |
nM |
422.49 |
CS(=O)(=O)O.O=C(NCc1cccc(O)c1)Nc1nc(-c2ccncc2)cs1 |
Homo sapiens |
CHEMBL3224482 |
single protein format |
CHEMBL4439133 |
OBDepict
H
N
N
CH
3
S
N
O
N
H
H
HN
ClH
ClH
|
IC50 |
= |
64.6 |
nM |
388.32 |
Cc1n[nH]cc1-c1cc2nc([C@@H]3CCCCN3)[nH]c(=O)c2s1.Cl.Cl |
Homo sapiens |
CHEMBL4325337 |
assay format |
CHEMBL388978 |
OBDepict
CH
3
HN
H
H
O
H
O
N
H
3
C
H
3
C
N
O
N
H
|
IC50 |
= |
105.0 |
nM |
466.54 |
CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 |
Homo sapiens |
CHEMBL4328387 |
single protein format |
CHEMBL10 |
OBDepict
F
N
N
H
N
+
S
H
3
C
_
O
|
IC50 |
< |
1000.0 |
nM |
377.44 |
C[S+]([O-])c1ccc(-c2nc(-c3ccc(F)cc3)c(-c3ccncc3)[nH]2)cc1 |
Homo sapiens |
CHEMBL4602943 |
single protein format |