molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL3900457 |
|
IC50 |
= |
70.0 |
nM |
328.38 |
C/C(=Cc1cccc(/C=C(C)C(=O)NC(=N)N)c1)C(=O)N=C(N)N |
Homo sapiens |
CHEMBL3881462 |
cell-based format |
CHEMBL3957275 |
OBDepict
F
H
3
C
H
N
N
H
2
N
NH
2
|
IC50 |
= |
310.0 |
nM |
310.38 |
Cc1ccc(F)cc1[C@H]1C/C(=NN=C(N)N)c2ccccc2C1 |
Homo sapiens |
CHEMBL3881462 |
cell-based format |
CHEMBL3974005 |
OBDepict
NH
2
N
NH
2
N
H
CH
3
H
3
C
F
|
IC50 |
= |
310.0 |
nM |
324.4 |
Cc1ccc(F)cc1[C@H]1C/C(=NN=C(N)N)c2c(C)cccc2C1 |
Homo sapiens |
CHEMBL3882218 |
single protein format |
CHEMBL3980085 |
OBDepict
F
H
3
C
H
N
N
H
2
N
NH
2
|
IC50 |
= |
430.0 |
nM |
310.38 |
Cc1ccc(F)cc1[C@@H]1C/C(=NN=C(N)N)c2ccccc2C1 |
Homo sapiens |
CHEMBL3881462 |
cell-based format |
CHEMBL3900790 |
OBDepict
NH
2
N
NH
2
N
H
CH
3
H
3
C
F
|
IC50 |
= |
430.0 |
nM |
324.4 |
Cc1ccc(F)cc1[C@@H]1C/C(=NN=C(N)N)c2c(C)cccc2C1 |
Homo sapiens |
CHEMBL3882218 |
single protein format |