molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL4789364 |
|
IC50 |
= |
200.0 |
nM |
394.47 |
CN(C(=O)C1CC(F)(F)C1)[C@H]1CCN(C(=O)c2ccc(NC(C)(C)C)nc2)C1 |
Homo sapiens |
CHEMBL4730318 |
single protein format |
CHEMBL4756953 |
OBDepict
OH
N
H
CH
3
H
3
C
N
N
O
H
N
CH
3
O
CH
3
|
IC50 |
= |
200.0 |
nM |
348.45 |
CC(=O)N(C)[C@H]1CCN(C(=O)c2ccc(NC(C)(C)CCO)nc2)C1 |
Homo sapiens |
CHEMBL4730318 |
single protein format |
CHEMBL4760519 |
OBDepict
CH
3
NH
CH
3
CH
3
N
N
O
H
N
H
3
C
O
H
3
C
|
IC50 |
= |
200.0 |
nM |
332.45 |
CCC(C)(C)Nc1ccc(C(=O)N2CC[C@H](N(C)C(C)=O)C2)cn1 |
Homo sapiens |
CHEMBL4730318 |
single protein format |
CHEMBL4753498 |
OBDepict
O
N
H
O
H
3
C
H
N
O
N
HN
CH
3
CH
3
H
3
C
|
IC50 |
= |
300.0 |
nM |
374.49 |
CN(C(=O)[C@@H]1CCCO1)[C@H]1CCN(C(=O)c2ccc(NC(C)(C)C)nc2)C1 |
Homo sapiens |
CHEMBL4730318 |
single protein format |
CHEMBL4799998 |
OBDepict
O
O
N
H
N
O
N
N
H
CH
3
H
3
C
CH
3
|
IC50 |
= |
300.0 |
nM |
332.4 |
CC(C)(C)Nc1ccc(C(=O)N2CC[C@H](N3CCOC3=O)C2)cn1 |
Homo sapiens |
CHEMBL4730318 |
single protein format |
CHEMBL4752209 |
OBDepict
O
N
N
H
3
C
N
H
N
CH
3
CH
3
H
3
C
|
IC50 |
= |
300.0 |
nM |
324.43 |
CC(C)(C)Nc1ccc(C(=O)N2CC(C)(c3ccccn3)C2)cn1 |
Homo sapiens |
CHEMBL4730318 |
single protein format |