BDBM50003239 2,2-Dimethyl-butyric acid 2-hydroxy-8-[2-(4-hydroxy-6-oxo-tetrahydro-pyran-2-yl)-ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydro-naphthalen-1-yl ester::CHEMBL3349824

SMILES CCC(C)(C)C(=O)O[C@H]1[C@@H](O)[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)C12

InChI Key InChIKey=FRSLCFUAVZLPDI-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50003239   

Target3-hydroxy-3-methylglutaryl-coenzyme A reductase(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50003239(2,2-Dimethyl-butyric acid 2-hydroxy-8-[2-(4-hydrox...)
Affinity DataIC50: 13nMAssay Description:The compound was tested in vitro for inhibitory activity against HMG-CoA reductaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed