molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL3808747 |
|
IC50 |
= |
62.0 |
nM |
519.6 |
OCCCCOc1cc(CNc2nc3ccccc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)ccc1-c1ccccc1 |
Homo sapiens |
CHEMBL3813158 |
cell-based format |
CHEMBL3427690 |
OBDepict
HO
H
O
H
OH
H
N
H
HO
NH
N
N
N
H
2
N
|
IC50 |
= |
640.0 |
nM |
448.48 |
Nc1ncnc2c1nc(NCc1ccc(-c3ccccc3)cc1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |
Homo sapiens |
CHEMBL3428943 |
cell-based format |
CHEMBL3809613 |
OBDepict
HO
O
NH
N
N
N
H
O
H
2
N
N
H
HO
H
H
OH
OH
|
IC50 |
= |
940.0 |
nM |
536.59 |
Nc1ncnc2c1nc(NCc1ccc(-c3ccccc3)c(OCCCCO)c1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |
Homo sapiens |
CHEMBL3813158 |
cell-based format |
CHEMBL3809974 |
OBDepict
HO
H
O
H
OH
H
N
H
HO
NH
N
N
N
H
2
N
N
|
IC50 |
= |
1000.0 |
nM |
449.47 |
Nc1ncnc2c1nc(NCc1ccc(-c3cccnc3)cc1)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |
Homo sapiens |
CHEMBL3813158 |
cell-based format |