molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL4584197 |
|
IC50 |
= |
175.0 |
nM |
504.51 |
Cc1c(NC(=O)c2noc3c2CCCc2cc(OC(F)(F)F)ccc2-3)c(=O)n(C2CCCCC2)n1C |
Homo sapiens |
CHEMBL4418374 |
single protein format |
CHEMBL4475920 |
OBDepict
O
N
H
N
O
H
3
C
N
O
N
CH
3
Cl
Cl
O
F
F
F
|
IC50 |
= |
390.0 |
nM |
567.35 |
Cc1c(NC(=O)c2noc3c2CCCc2cc(OC(F)(F)F)ccc2-3)c(=O)n(-c2c(Cl)cccc2Cl)n1C |
Homo sapiens |
CHEMBL4418374 |
single protein format |
CHEMBL4559578 |
OBDepict
O
N
H
N
O
CH
3
N
O
N
S
H
3
C
O
F
F
F
|
IC50 |
= |
725.0 |
nM |
522.55 |
Cc1c(NC(=O)c2noc3c2CCSc2cc(OC(F)(F)F)ccc2-3)c(=O)n(C2CCCCC2)n1C |
Homo sapiens |
CHEMBL4418374 |
single protein format |
CHEMBL4468431 |
OBDepict
CH
3
H
3
C
O
N
N
H
O
CH
3
N
O
N
H
3
C
Cl
|
IC50 |
= |
740.0 |
nM |
505.02 |
Cc1c(NC(=O)c2noc3c2CCCc2cc(CC(C)C)ccc2-3)c(=O)n(-c2ccccc2Cl)n1C |
Homo sapiens |
CHEMBL4418374 |
single protein format |
CHEMBL4473531 |
OBDepict
O
N
H
N
O
H
3
C
N
O
N
CH
3
F
O
F
F
F
|
IC50 |
= |
830.0 |
nM |
516.45 |
Cc1c(NC(=O)c2noc3c2CCCc2cc(OC(F)(F)F)ccc2-3)c(=O)n(-c2ccccc2F)n1C |
Homo sapiens |
CHEMBL4418374 |
single protein format |