molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL388978 |
|
IC50 |
= |
2.58 |
nM |
466.54 |
CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 |
Homo sapiens |
CHEMBL4328553 |
single protein format |
CHEMBL3815054 |
OBDepict
H
3
C
N
CH
3
N
N
N
O
H
N
N
H
|
IC50 |
= |
78.0 |
nM |
436.52 |
CN(C)CCCn1cc(-c2ccc3c(c2)-c2[nH]c4cc(-c5cn[nH]c5)ccc4c2C3=O)cn1 |
Homo sapiens |
CHEMBL3816306 |
single protein format |
CHEMBL4062218 |
OBDepict
CH
3
N
H
O
O
N
H
CH
3
N
N
O
N
H
O
N
H
3
C
|
IC50 |
= |
136.0 |
nM |
512.57 |
CNC(=O)c1ccc(Nc2nc(OC3CCCC3)c3c(-c4ccc5nc(C)oc5c4)c[nH]c3n2)c(OC)c1 |
Homo sapiens |
CHEMBL4031759 |
assay format |