molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL46 |
|
IC50 |
= |
160.0 |
nM |
293.37 |
Cc1nccn1CC1CCc2c(c3ccccc3n2C)C1=O |
Homo sapiens |
CHEMBL2320300 |
cell-based format |
CHEMBL941 |
OBDepict
H
3
C
N
N
N
H
O
N
H
CH
3
N
N
N
|
IC50 |
= |
350.0 |
nM |
493.62 |
Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1 |
Homo sapiens |
CHEMBL2320300 |
cell-based format |
CHEMBL790 |
OBDepict
NH
HN
N
H
HN
NH
Cl
N
H
HN
NH
HN
NH
Cl
|
IC50 |
= |
500.0 |
nM |
505.46 |
N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1 |
Homo sapiens |
CHEMBL2320304 |
cell-based format |
CHEMBL58 |
OBDepict
HO
HN
NH
O
HN
O
OH
OH
NH
OH
|
IC50 |
= |
530.0 |
nM |
444.49 |
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCCNCCO)ccc(NCCNCCO)c21 |
Homo sapiens |
CHEMBL2320300 |
cell-based format |