molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL4436298 |
|
Ki |
= |
0.2 |
nM |
516.58 |
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)P(=O)(O)C[C@@H](CCc1ccccc1)C(=O)O |
Homo sapiens |
CHEMBL4413959 |
single protein format |
CHEMBL4528407 |
OBDepict
H
3
C
CH
3
N
H
H
N
H
O
O
CH
3
P
CH
3
H
O
OH
H
O
HO
|
Ki |
= |
0.7 |
nM |
440.48 |
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)P(=O)(O)C[C@@H](CCc1ccccc1)C(=O)O |
Homo sapiens |
CHEMBL4413959 |
single protein format |
CHEMBL4460840 |
OBDepict
H
3
C
CH
3
N
H
H
NH
O
O
CH
3
P
H
O
OH
H
O
OH
|
Ki |
= |
1.0 |
nM |
502.55 |
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)P(=O)(O)C[C@@H](Cc1ccccc1)C(=O)O |
Homo sapiens |
CHEMBL4413959 |
single protein format |
CHEMBL4483485 |
OBDepict
H
3
C
HN
O
H
N
H
O
P
CH
3
H
O
OH
OH
H
O
HO
|
Ki |
= |
1.7 |
nM |
490.49 |
CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)P(=O)(O)C[C@@H](CCc1ccccc1)C(=O)O |
Homo sapiens |
CHEMBL4413959 |
single protein format |
CHEMBL4532731 |
OBDepict
NH
2
HN
H
N
H
O
O
CH
3
P
H
3
C
H
O
OH
H
O
HO
|
Ki |
= |
2.4 |
nM |
455.49 |
CC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)P(=O)(O)C[C@@H](CCc1ccccc1)C(=O)O |
Homo sapiens |
CHEMBL4413959 |
single protein format |
CHEMBL4453900 |
OBDepict
H
3
C
N
O
H
N
H
O
P
CH
3
H
O
OH
H
O
HO
|
Ki |
= |
3.2 |
nM |
424.43 |
CC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)P(=O)(O)C[C@@H](CCc1ccccc1)C(=O)O |
Homo sapiens |
CHEMBL4413959 |
single protein format |
CHEMBL4448096 |
OBDepict
H
3
C
NH
O
H
N
H
O
P
H
3
C
H
O
HO
O
OH
H
O
OH
|
Ki |
= |
4.6 |
nM |
456.43 |
CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)P(=O)(O)C[C@@H](CCc1ccccc1)C(=O)O |
Homo sapiens |
CHEMBL4413959 |
single protein format |
CHEMBL4513310 |
OBDepict
H
2
N
O
O
N
H
O
H
HN
O
P
CH
3
H
O
OH
OH
H
O
OH
|
Ki |
= |
7.8 |
nM |
593.61 |
C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)COCCOCCN)P(=O)(O)C[C@@H](CCc1ccccc1)C(=O)O |
Homo sapiens |
CHEMBL4413959 |
single protein format |
CHEMBL4440735 |
OBDepict
OH
N
H
H
N
H
O
O
CH
3
P
CH
3
H
O
OH
H
O
HO
|
Ki |
= |
13.8 |
nM |
414.4 |
CC(=O)N[C@@H](CO)C(=O)N[C@@H](C)P(=O)(O)C[C@@H](CCc1ccccc1)C(=O)O |
Homo sapiens |
CHEMBL4413959 |
single protein format |