molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL514138 |
|
IC50 |
= |
1.5 |
nM |
429.93 |
COc1ccc(S(=O)(=O)N(Cc2cccnc2)[C@@H](C(=O)NO)C(C)C)cc1.Cl |
Homo sapiens |
CHEMBL1799653 |
single protein format |
CHEMBL1795862 |
OBDepict
CH
3
S
S
N
O
O
H
NH
O
HO
|
IC50 |
= |
3.4 |
nM |
494.64 |
CCCCc1ccc(C#Cc2ccc(S(=O)(=O)N3Cc4ccccc4C[C@@H]3C(=O)NO)s2)cc1 |
Homo sapiens |
CHEMBL1799653 |
single protein format |
CHEMBL1795351 |
OBDepict
H
3
C
S
S
NH
O
O
N
H
O
HO
|
IC50 |
= |
34.0 |
nM |
392.5 |
CCCCc1ccc(C#Cc2ccc(S(=O)(=O)NCC(=O)NO)s2)cc1 |
Homo sapiens |
CHEMBL1799653 |
single protein format |
CHEMBL1795857 |
OBDepict
H
3
C
S
S
NH
O
O
H
N
H
O
OH
O
|
IC50 |
= |
38.0 |
nM |
588.75 |
CCCCc1ccc(C#Cc2ccc(S(=O)(=O)N[C@H](Cc3ccc(OCc4ccccc4)cc3)C(=O)NO)s2)cc1 |
Homo sapiens |
CHEMBL1799653 |
single protein format |
CHEMBL1795859 |
OBDepict
H
3
C
S
S
NH
O
O
H
N
H
O
OH
N
H
|
IC50 |
= |
76.0 |
nM |
521.66 |
CCCCc1ccc(C#Cc2ccc(S(=O)(=O)N[C@H](Cc3c[nH]c4ccccc34)C(=O)NO)s2)cc1 |
Homo sapiens |
CHEMBL1799653 |
single protein format |
CHEMBL1795861 |
OBDepict
H
3
C
S
S
N
O
O
S
H
N
H
O
HO
|
IC50 |
= |
170.0 |
nM |
450.61 |
CCCCc1ccc(C#Cc2ccc(S(=O)(=O)N3CSC[C@H]3C(=O)NO)s2)cc1 |
Homo sapiens |
CHEMBL1799653 |
single protein format |
CHEMBL1795860 |
OBDepict
H
3
C
S
S
NH
O
O
H
N
H
O
OH
S
|
IC50 |
= |
220.0 |
nM |
538.72 |
CCCCc1ccc(C#Cc2ccc(S(=O)(=O)N[C@H](Cc3csc4ccccc34)C(=O)NO)s2)cc1 |
Homo sapiens |
CHEMBL1799653 |
single protein format |
CHEMBL1795858 |
OBDepict
CH
3
S
S
NH
O
O
H
N
H
O
OH
O
|
IC50 |
= |
340.0 |
nM |
586.74 |
CCCCc1ccc(C#Cc2ccc(S(=O)(=O)N[C@H](Cc3ccc(C(=O)c4ccccc4)cc3)C(=O)NO)s2)cc1 |
Homo sapiens |
CHEMBL1799653 |
single protein format |