Novel squalene-hopene cyclase inhibitors derived from hydroxycoumarins and hydroxyacetophenones

Chem Pharm Bull (Tokyo). 2004 Oct;52(10):1171-4. doi: 10.1248/cpb.52.1171.

Abstract

Squalene-hopene cyclase (SHC) is a useful model enzyme for predicting molecular interactions with oxidosqualene cyclase (OSC). Structure--activity relationships were investigated for numerous coumarin-derived inhibitors of SHC, and structural simplifications are suggested. Both umbelliferone and 2,4-dihydroxyacetophenone provide convenient starting nuclei for the design of SHC inhibitors. Derivatives bearing an omega-epoxyfarnesyl moiety or just a plain alkyl chain showed an inhibitory effect on a recombinant SHC from Alicyclobacillus acidocaldarius expressed in Escherichia coli.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Acetophenones / chemical synthesis
  • Acetophenones / chemistry*
  • Bacillaceae / chemistry
  • Intramolecular Transferases / antagonists & inhibitors*
  • Intramolecular Transferases / chemistry
  • Structure-Activity Relationship
  • Umbelliferones / chemical synthesis
  • Umbelliferones / chemistry*

Substances

  • Acetophenones
  • Umbelliferones
  • 2,6-dihydroxyacetophenone
  • Intramolecular Transferases
  • squalene-hopene cyclase