Diversity-Oriented Synthesis-Facilitated Medicinal Chemistry: Toward the Development of Novel Antimalarial Agents

نویسندگان

  • Eamon Comer
  • Jennifer A. Beaudoin
  • Nobutaka Kato
  • Mark E. Fitzgerald
  • Richard W. Heidebrecht
  • Maurice duPont Lee
  • Daniela Masi
  • Marion Mercier
  • Carol Mulrooney
  • Giovanni Muncipinto
  • Ann Rowley
  • Keila Crespo-Llado
  • Adelfa E. Serrano
  • Amanda K. Lukens
  • Roger C. Wiegand
  • Dyann F. Wirth
  • Michelle A. Palmer
  • Michael A. Foley
  • Benito Munoz
  • Christina A. Scherer
  • Jeremy R. Duvall
  • Stuart L. Schreiber
چکیده

Here, we describe medicinal chemistry that was accelerated by a diversity-oriented synthesis (DOS) pathway, and in vivo studies of our previously reported macrocyclic antimalarial agent that derived from the synthetic pathway. Structure-activity relationships that focused on both appendage and skeletal features yielded a nanomolar inhibitor of P. falciparum asexual blood-stage growth with improved solubility and microsomal stability and reduced hERG binding. The build/couple/pair (B/C/P) synthetic strategy, used in the preparation of the original screening library, facilitated medicinal chemistry optimization of the antimalarial lead.

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عنوان ژورنال:

دوره 57  شماره 

صفحات  -

تاریخ انتشار 2014