molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL3642160 |
|
IC50 |
= |
23.0 |
nM |
550.91 |
CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(Cl)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 |
Homo sapiens |
CHEMBL3707767 |
cell-based format |
CHEMBL3642157 |
OBDepict
Br
N
O
CH
3
H
N
O
Cl
Cl
N
O
H
3
C
|
IC50 |
= |
24.0 |
nM |
595.37 |
CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(Br)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 |
Homo sapiens |
CHEMBL3707767 |
cell-based format |
CHEMBL3642159 |
OBDepict
H
3
C
N
O
CH
3
H
N
O
Cl
Cl
N
O
H
3
C
|
IC50 |
= |
49.0 |
nM |
530.5 |
CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(C)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 |
Homo sapiens |
CHEMBL3707767 |
cell-based format |
CHEMBL3642158 |
OBDepict
H
3
C
O
N
O
CH
3
H
N
O
Cl
Cl
N
O
CH
3
|
IC50 |
= |
130.0 |
nM |
546.5 |
COc1ccc(C(=O)N(C)[C@@H]2CCN(C(=O)C3CCN(C(C)=O)CC3)CC2c2ccc(Cl)c(Cl)c2)cc1 |
Homo sapiens |
CHEMBL3707767 |
cell-based format |
CHEMBL3642161 |
OBDepict
O
N
N
H
N
CH
3
O
H
3
C
O
Cl
Cl
|
IC50 |
= |
160.0 |
nM |
592.57 |
CC(=O)N1CCC(C(=O)N2CC[C@@H](N(C)C(=O)c3ccc(-c4ccccc4)cc3)C(c3ccc(Cl)c(Cl)c3)C2)CC1 |
Homo sapiens |
CHEMBL3707767 |
cell-based format |