molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL224730 |
|
Ki |
= |
3.0 |
nM |
514.57 |
C[n+]1c[nH]cc1C[C@H](N)C(=O)N1C(=O)CC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(N)=O |
Homo sapiens |
CHEMBL917826 |
single protein format |
CHEMBL223972 |
OBDepict
O
N
H
H
N
H
O
H
N
O
N
H
N
O
NH
2
H
3
C
|
Ki |
= |
3.2 |
nM |
390.44 |
Cn1cnc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c1 |
Homo sapiens |
CHEMBL917826 |
single protein format |
CHEMBL390942 |
OBDepict
CH
3
N
N
HN
H
N
O
O
H
H
NH
O
NH
2
O
|
Ki |
= |
11.0 |
nM |
404.47 |
CCn1cnc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c1 |
Homo sapiens |
CHEMBL917826 |
single protein format |
CHEMBL1472 |
OBDepict
O
N
H
H
N
H
O
H
N
O
N
H
N
H
O
H
2
N
|
Ki |
= |
20.0 |
nM |
362.39 |
NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1 |
Homo sapiens |
CHEMBL917826 |
single protein format |
CHEMBL224525 |
OBDepict
CH
3
N
N
H
N
H
H
N
O
O
H
H
NH
O
NH
2
O
|
Ki |
= |
400.0 |
nM |
418.5 |
CCCc1nc(C[C@H](NC(=O)[C@@H]2CCCC(=O)N2)C(=O)N2CCC[C@H]2C(N)=O)c[nH]1 |
Homo sapiens |
CHEMBL917826 |
single protein format |