BDBM50004775 2-Methyl-butyric acid 3-hydroxy-8-[2-(4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-7-methyl-1,2,3,4,4a,7,8,8a-octahydro-naphthalen-1-yl ester::CHEMBL115307

SMILES CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C[C@@H]2C=C[C@H](C)[C@H](CCC3C[C@@H](O)CC(=O)O3)[C@@H]12

InChI Key InChIKey=LJOOWESTVASNOG-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50004775   

Target3-hydroxy-3-methylglutaryl-coenzyme A reductase(Human)
British Bio-Technology

Curated by ChEMBL
LigandPNGBDBM50004775(CHEMBL115307 | 2-Methyl-butyric acid 3-hydroxy-8-[...)
Affinity DataIC50: 1.40E+3nMAssay Description:Concentration required to inhibit HMG-CoA reductase by 50% was determined in Hep G2 cell lineMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/23/2012
Entry Details Article
PubMed