BDBM50154557 CHEMBL3775481

SMILES CC(=O)O[C@H]1CC[C@]2(C)[C@H]3C(=O)C=C4[C@@H]5C[C@@](C)(C#N)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@H]2C1(C)C

InChI Key InChIKey=GBQQBVYMDCLTKC-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50154557   

TargetLiver carboxylesterase 1(Human)
Dalian Institute of Chemical Physics

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50154557BDBM50154557(CHEMBL3775481)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of CE1 in human liver microsomes using 2-(2-Benzoyl-3-methoxyphenyl) benzothiazole as substrate preincubated for 10 mins followed by subst...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/7/2017
Entry Details Article
PubMed
TargetCocaine esterase(Human)
Dalian Institute of Chemical Physics

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50154557BDBM50154557(CHEMBL3775481)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of CE2 in human liver microsomes using fluorescein diacetate as substrate preincubated for 10 mins followed by substrate addition measured...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/7/2017
Entry Details Article
PubMed