Discovery of N-(2-aminoethyl)-N-benzyloxyphenyl benzamides: New potent Trypanosoma brucei inhibitors

Bioorg Med Chem. 2017 Mar 1;25(5):1571-1584. doi: 10.1016/j.bmc.2016.11.019. Epub 2016 Nov 12.

Abstract

A phenotypic screen of a compound library for antiparasitic activity on Trypanosoma brucei, the causative agent of Human African Trypanosomiasis (HAT), led to the identification of N-(2-aminoethyl)-N-phenyl benzamides as a starting point for hit-to-lead medicinal chemistry. Eighty two analogues were prepared, which led to the identification of a set of highly potent N-(2-aminoethyl)-N-benzyloxyphenyl benzamides with the most potent compound 73 having an in vitro EC50=0.001μM. The compounds displayed drug-like properties when tested in a number of in vitro assays. Compound 73 was orally bioavailable and displayed good plasma and brain exposure in mice, cured 2 out of 3 mice infected with Trypanosoma brucei in acute model when dosed orally at 50mg/kg once per day for 4days. Given its potent antiparasitic properties and its ease of synthesis, compound 73 represents a potential lead for the development of drug to treat Human African Trypanosomiasis.

Keywords: Hit-to-lead optimization; Human African Trypanosomiasis; Trypanosoma brucei inhibitor; “Sleeping Sickness”.

Publication types

  • Research Support, N.I.H., Extramural

MeSH terms

  • Administration, Oral
  • Animals
  • Antiprotozoal Agents / pharmacokinetics
  • Antiprotozoal Agents / pharmacology*
  • Antiprotozoal Agents / therapeutic use
  • Benzamides / pharmacology*
  • Biological Availability
  • Drug Discovery
  • Mice
  • Structure-Activity Relationship
  • Trypanosoma brucei brucei / drug effects*
  • Trypanosomiasis / drug therapy

Substances

  • Antiprotozoal Agents
  • Benzamides