BDBM50280940 CHEMBL293448::Tripotassium ; [1-({2-[Benzyl-((2E,6E)-3,7,11-trimethyl-dodeca-2,6,10-trienyl)-amino]-ethyl}-hydroxy-phosphinoyl)-1-methyl-ethyl]-phosphonate

SMILES [#6]\[#6](-[#6])=[#6]/[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#7](-[#6]-[#6]P([#8-])(=O)C([#6])([#6])P([#8-])([#8-])=O)-[#6]-c1ccccc1

InChI Key InChIKey=XJAGYTJHQWHIST-UHFFFAOYSA-K

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50280940   

TargetSqualene synthase(Rat)
TBA

Curated by ChEMBL
LigandPNGBDBM50280940(Tripotassium ; [1-({2-[Benzyl-((2E,6E)-3,7,11-trim...)
Affinity DataIC50: 20nMAssay Description:Tested for the squalene synthetase inhibitory activity in rat liver microsomal assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2012
Entry Details Article