molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL1078003 |
|
IC50 |
= |
116.0 |
nM |
401.59 |
CN1C(=O)CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]45CCC(C)(C)C(=O)O5)[C@@H]3CC[C@@H]12 |
Homo sapiens |
CHEMBL1106730 |
cell-based format |
CHEMBL1080041 |
OBDepict
CH
3
N
H
3
C
H
CH
3
H
H
H
CH
3
H
N
CH
3
O
|
IC50 |
= |
189.0 |
nM |
416.69 |
CCCCCCCN(C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@@]21C |
Homo sapiens |
CHEMBL1106730 |
cell-based format |
CHEMBL1079512 |
OBDepict
H
3
C
N
O
CH
3
H
H
H
CH
3
H
N
CH
3
O
|
IC50 |
= |
195.0 |
nM |
472.76 |
CCCCCCCCCCN(C=O)C1CC[C@H]2[C@@H]3CC[C@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |
Homo sapiens |
CHEMBL1106730 |
cell-based format |