BDBM50292861 1-Phosphono-4-[3-(2-trifluoromethylphenoxy)phenyl]butylsulfonic Acid Tripotassium Salt::CHEMBL474135

SMILES [O-]P([O-])(=O)C(CCCc1cccc(Oc2ccccc2C(F)(F)F)c1)S([O-])(=O)=O

InChI Key InChIKey=VSNCPMXLRLQUNA-UHFFFAOYSA-K

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 = 50292861   

Target4,4'-diapophytoene synthase(Staphylococcus aureus)
University of Illinois At Urbana-Champaign

Curated by ChEMBL
LigandPNGBDBM50292861(1-Phosphono-4-[3-(2-trifluoromethylphenoxy)phenyl]...)
Affinity DataIC50: 5.37E+4nMAssay Description:Inhibition of Staphylococcus aureus dehydrosqualene synthase expressed in Escherichia coli BL21 (DE3) cells by continuous spectrophotometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2010
Entry Details Article
PubMed
TargetSqualene synthase(Human)
University of Illinois At Urbana-Champaign

Curated by ChEMBL
LigandPNGBDBM50292861(1-Phosphono-4-[3-(2-trifluoromethylphenoxy)phenyl]...)
Affinity DataIC50: 180nMAssay Description:Inhibition of human recombinant squalene synthase expressed in Escherichia coli BL21 (DE3) cells assessed as formation of 1,10-dioic acid metabolite ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/25/2010
Entry Details Article
PubMed