'Bridged' stilbene derivatives as selective cyclooxygenase-1 inhibitors

Bioorg Med Chem. 2007 Sep 15;15(18):6109-18. doi: 10.1016/j.bmc.2007.06.030. Epub 2007 Jun 20.

Abstract

Resveratrol ((E)-3,4',5-trihydroxy-stilbene), a phytoalexin found in various plants, shows non-selective cyclooxygenase-1 (COX-1) and cyclooxygenase-2 (COX-2) inhibition. In order to find more selective COX inhibitors a series of bridged stilbene derivatives was synthesized and evaluated for their ability to inhibit both COX-1 and COX-2 in vitro. The compounds showed a high rate of COX-1 inhibition with the most potent compounds exhibiting submicromolar IC(50) values and high selectivity indices. A prediction model for COX-inhibiting activity was also developed using the classical LIE approach resulting in consistent docking data for our molecule sample. Phenyl substituted 1,2-dihydronaphthalene derivatives and 1H-indene derivatives therefore represent a novel class of highly selective COX-1 inhibitors and land promising candidates for in vivo studies.

MeSH terms

  • Animals
  • Computer Simulation
  • Cyclooxygenase 1 / chemistry*
  • Cyclooxygenase 1 / metabolism
  • Cyclooxygenase Inhibitors / chemical synthesis
  • Cyclooxygenase Inhibitors / chemistry
  • Cyclooxygenase Inhibitors / pharmacology*
  • Female
  • Guinea Pigs
  • Indenes / chemical synthesis
  • Indenes / chemistry
  • Indenes / pharmacology*
  • Male
  • Models, Molecular
  • Molecular Structure
  • Muscles / drug effects*
  • Naphthalenes / chemical synthesis
  • Naphthalenes / chemistry
  • Naphthalenes / pharmacology*
  • Resveratrol
  • Stilbenes
  • Structure-Activity Relationship

Substances

  • Cyclooxygenase Inhibitors
  • Indenes
  • Naphthalenes
  • Stilbenes
  • 1,2-dihydronaphthalene
  • Cyclooxygenase 1
  • Resveratrol