molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL2313653 |
|
IC50 |
= |
400.0 |
nM |
274.38 |
Cc1ccc(S(=O)(=O)c2c(C)cc(C)cc2C)cc1 |
Homo sapiens |
CHEMBL3269756 |
single protein format |
CHEMBL3809313 |
OBDepict
H
3
C
N
H
CH
3
CH
3
CH
3
CH
3
H
3
C
|
IC50 |
= |
400.0 |
nM |
253.39 |
Cc1cc(C)c(Nc2c(C)cc(C)cc2C)c(C)c1 |
Homo sapiens |
CHEMBL3810792 |
single protein format |
CHEMBL3808936 |
OBDepict
CH
3
H
3
C
CH
3
N
H
CH
3
Cl
|
IC50 |
= |
500.0 |
nM |
259.78 |
Cc1cc(C)c(Nc2cccc(Cl)c2C)c(C)c1 |
Homo sapiens |
CHEMBL3810792 |
single protein format |
CHEMBL3808997 |
OBDepict
Cl
N
H
F
F
F
H
3
C
CH
3
CH
3
|
IC50 |
= |
500.0 |
nM |
313.75 |
Cc1cc(C)c(Nc2cc(Cl)cc(C(F)(F)F)c2)c(C)c1 |
Homo sapiens |
CHEMBL3810792 |
single protein format |
CHEMBL3260989 |
OBDepict
CH
3
O
+
N
CH
3
S
N
H
CH
3
CH
3
H
3
C
_
I
|
IC50 |
= |
600.0 |
nM |
432.37 |
COCCC[n+]1c(C)csc1Nc1c(C)cc(C)cc1C.[I-] |
Homo sapiens |
CHEMBL3269756 |
single protein format |
CHEMBL3809121 |
OBDepict
CH
3
H
3
C
CH
3
N
H
F
F
F
F
F
F
|
IC50 |
= |
600.0 |
nM |
347.3 |
Cc1cc(C)c(Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C)c1 |
Homo sapiens |
CHEMBL3810792 |
single protein format |
CHEMBL3808792 |
OBDepict
CH
3
H
3
C
CH
3
N
H
CH
3
Cl
Cl
|
IC50 |
= |
700.0 |
nM |
294.23 |
Cc1cc(C)c(Nc2c(C)cc(Cl)cc2Cl)c(C)c1 |
Homo sapiens |
CHEMBL3810792 |
single protein format |
CHEMBL3808606 |
OBDepict
CH
3
H
3
C
CH
3
N
H
Cl
F
F
F
|
IC50 |
= |
1000.0 |
nM |
313.75 |
Cc1cc(C)c(Nc2ccc(Cl)c(C(F)(F)F)c2)c(C)c1 |
Homo sapiens |
CHEMBL3810793 |
single protein format |
CHEMBL3808989 |
OBDepict
CH
3
H
3
C
CH
3
N
H
CH
3
H
3
C
|
IC50 |
= |
1000.0 |
nM |
239.36 |
Cc1cc(C)c(Nc2cccc(C)c2C)c(C)c1 |
Homo sapiens |
CHEMBL3810792 |
single protein format |