molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL4780770 |
|
IC50 |
= |
760.0 |
nM |
541.7 |
CCNc1ccc2sc(C(=O)NCc3cccc(NC(=O)c4cccs4)c3)c(OCc3ccccc3)c2c1 |
Homo sapiens |
CHEMBL4772833 |
cell-based format |
CHEMBL4791433 |
OBDepict
O
N
H
S
O
N
N
H
CH
3
CH
3
O
S
|
IC50 |
= |
790.0 |
nM |
541.7 |
CN(C)c1ccc2sc(C(=O)NCc3cccc(NC(=O)c4cccs4)c3)c(OCc3ccccc3)c2c1 |
Homo sapiens |
CHEMBL4772833 |
cell-based format |
CHEMBL2012938 |
OBDepict
O
O
O
OH
OH
O
HO
OH
|
Ki |
= |
930.0 |
nM |
562.57 |
O=C(Cc1ccccc1)Oc1c(OC(=O)Cc2ccccc2)c(-c2ccc(O)cc2)c(O)c(O)c1-c1ccc(O)cc1 |
Homo sapiens |
CHEMBL4479673 |
assay format |
CHEMBL4792569 |
OBDepict
CH
3
HN
S
O
NH
O
N
H
O
S
|
IC50 |
= |
1000.0 |
nM |
527.67 |
CNc1ccc2sc(C(=O)NCc3cccc(NC(=O)c4cccs4)c3)c(OCc3ccccc3)c2c1 |
Homo sapiens |
CHEMBL4772833 |
cell-based format |