molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL4555677 |
|
IC50 |
= |
62.0 |
nM |
371.26 |
O=C(Nc1cccc2[nH]ccc12)c1cc2ccc(Br)cc2s1 |
Homo sapiens |
CHEMBL4358945 |
assay format |
CHEMBL4543218 |
OBDepict
I
S
NH
O
N
H
|
IC50 |
= |
92.0 |
nM |
418.26 |
O=C(Nc1cccc2[nH]ccc12)c1cc2ccc(I)cc2s1 |
Homo sapiens |
CHEMBL4358945 |
assay format |
CHEMBL4462702 |
OBDepict
Cl
S
NH
O
N
H
|
IC50 |
= |
120.0 |
nM |
326.81 |
O=C(Nc1cccc2[nH]ccc12)c1cc2ccc(Cl)cc2s1 |
Homo sapiens |
CHEMBL4358945 |
assay format |
CHEMBL229457 |
OBDepict
NH
2
N
H
NH
NH
2
|
IC50 |
= |
140.0 |
nM |
172.28 |
N=C(N)NCCCCCCCN |
Homo sapiens |
CHEMBL4358945 |
assay format |
CHEMBL4442298 |
OBDepict
N
S
N
H
O
N
H
|
IC50 |
= |
430.0 |
nM |
317.37 |
N#Cc1ccc2cc(C(=O)Nc3cccc4[nH]ccc34)sc2c1 |
Homo sapiens |
CHEMBL4358945 |
assay format |
CHEMBL4447948 |
OBDepict
O
N
H
N
CH
3
H
3
C
CH
3
H
|
IC50 |
= |
840.0 |
nM |
292.38 |
CC(C)(C)c1ccc(C(=O)Nc2cccc3[nH]ccc23)cc1 |
Homo sapiens |
CHEMBL4358945 |
assay format |