Discovery and optimisation of a potent and selective tertiary sulfonamide oxytocin antagonist

Bioorg Med Chem Lett. 2009 Jan 15;19(2):528-32. doi: 10.1016/j.bmcl.2008.11.018. Epub 2008 Nov 12.

Abstract

The optimisation of a tertiary sulfonamide high-throughput screening hit is described. A combination of high-throughput chemistry, pharmacophore analysis and in silico PK profiling resulted in the discovery of potent sulfonamide oxytocin receptor antagonists with oral exposure and good selectivity over vasopressin receptors.

MeSH terms

  • Administration, Oral
  • Drug Discovery*
  • Models, Molecular
  • Oxytocin / antagonists & inhibitors*
  • Sulfonamides / administration & dosage
  • Sulfonamides / chemistry
  • Sulfonamides / pharmacology*

Substances

  • Sulfonamides
  • Oxytocin