Synthesis and biological evaluation of p38alpha kinase-targeting dialkynylimidazoles

Bioorg Med Chem Lett. 2009 Nov 15;19(22):6293-7. doi: 10.1016/j.bmcl.2009.09.094. Epub 2009 Sep 27.

Abstract

Based on the mild, thermal rearrangement of 1,2-dialkynylimidazoles to reactive carbene or diradical intermediates, a series of 1,2-dialkynylimidazoles were designed as potential irreversible p38 MAP kinase alpha-isoform (p38alpha) inhibitors. The synthesis of these dialkynylimidazoles and their kinase inhibition activity is reported. The 1-ethynyl-substituted dialkynylimidazole 14 is a potent (IC(50)=200 nM) and selective inhibitor of p38alpha. Moreover, compound 14 covalently modifies p38alpha as determined by ESI-MS after 12h incubation at 37 degrees C. The unique kinase inhibition, covalent kinase adduct formation, and minimal CYP450 2D6 inhibition by compound 14 demonstrate that dialkynylimidazoles are a new, promising class of p38alpha inhibitors.

Publication types

  • Research Support, N.I.H., Extramural
  • Research Support, Non-U.S. Gov't

MeSH terms

  • Allosteric Regulation
  • Crystallography, X-Ray
  • Drug Design
  • Imidazoles / chemistry
  • Imidazoles / metabolism*
  • Mitogen-Activated Protein Kinase 14 / metabolism
  • Models, Chemical
  • NF-kappa B / metabolism
  • Protein Kinase Inhibitors / pharmacology
  • Substrate Specificity
  • p38 Mitogen-Activated Protein Kinases / chemical synthesis*
  • p38 Mitogen-Activated Protein Kinases / metabolism
  • p38 Mitogen-Activated Protein Kinases / pharmacology

Substances

  • Imidazoles
  • NF-kappa B
  • Protein Kinase Inhibitors
  • Mitogen-Activated Protein Kinase 14
  • p38 Mitogen-Activated Protein Kinases