Lead Optimization to Advance Protease-Activated Receptor-1 Antagonists in Early Discovery

J Med Chem. 2022 Apr 14;65(7):5575-5592. doi: 10.1021/acs.jmedchem.1c02048. Epub 2022 Mar 29.

Abstract

Vorapaxar is an approved drug for the reduction of thrombotic cardiovascular events in patients with a history of myocardial infarction or with peripheral arterial disease. Subsequent to the discovery of Vorapaxar, medicinal chemistry efforts were continued to identify structurally differentiated leads. Toward this goal, extensive structure-activity relationship studies using a C-ring-truncated version of Vorapaxar culminated in the discovery of three leads, represented as 13, 14, and 23. Among these leads, compound 14 possessed favorable pharmacokinetic properties and an off-target profile, which supported additional profiling in an exploratory rat toxicology study.

MeSH terms

  • Animals
  • Humans
  • Lactones
  • Myocardial Infarction* / drug therapy
  • Platelet Aggregation Inhibitors
  • Rats
  • Receptor, PAR-1
  • Receptors, Proteinase-Activated
  • Thrombosis* / chemically induced
  • Thrombosis* / drug therapy

Substances

  • Lactones
  • Platelet Aggregation Inhibitors
  • Receptor, PAR-1
  • Receptors, Proteinase-Activated