Thiazolides as novel antiviral agents. 1. Inhibition of hepatitis B virus replication

J Med Chem. 2011 Jun 23;54(12):4119-32. doi: 10.1021/jm200153p. Epub 2011 May 23.

Abstract

We report the syntheses and activities of a wide range of thiazolides [viz., 2-hydroxyaroyl-N-(thiazol-2-yl)amides] against hepatitis B virus replication, with QSAR analysis of our results. The prototypical thiazolide, nitazoxanide [2-hydroxybenzoyl-N-(5-nitrothiazol-2-yl)amide, NTZ] 1 is a broad spectrum antiinfective agent effective against anaerobic bacteria, viruses, and parasites. By contrast, 2-hydroxybenzoyl-N-(5-chlorothiazol-2-yl)amide 3 is a novel, potent, and selective inhibitor of hepatitis B replication (EC(50) = 0.33 μm) but is inactive against anaerobes. Several 4'- and 5'-substituted thiazolides show good activity against HBV; by contrast, some related salicyloylanilides show a narrower spectrum of activity. The ADME properties of 3 are similar to 1; viz., the O-acetate is an effective prodrug, and the O-aryl glucuronide is a major metabolite. The QSAR study shows a good correlation of observed EC(90) for intracellular virions with thiazolide structural parameters. Finally we discuss the mechanism of action of thiazolides in relation to the present results.

Publication types

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

MeSH terms

  • Amides / chemical synthesis*
  • Amides / pharmacokinetics
  • Amides / pharmacology
  • Animals
  • Antiviral Agents / chemical synthesis*
  • Antiviral Agents / pharmacokinetics
  • Antiviral Agents / pharmacology
  • Dogs
  • Glucuronides / chemical synthesis
  • Glucuronides / pharmacokinetics
  • Glucuronides / pharmacology
  • Hep G2 Cells
  • Hepatitis B virus / drug effects*
  • Hepatitis B virus / physiology
  • Humans
  • In Vitro Techniques
  • Prodrugs / chemical synthesis*
  • Prodrugs / pharmacokinetics
  • Prodrugs / pharmacology
  • Quantitative Structure-Activity Relationship
  • Rats
  • Salicylamides / chemical synthesis*
  • Salicylamides / pharmacokinetics
  • Salicylamides / pharmacology
  • Thiazoles / chemical synthesis*
  • Thiazoles / pharmacokinetics
  • Thiazoles / pharmacology
  • Virion / drug effects
  • Virion / physiology
  • Virus Replication

Substances

  • 2-hydroxybenzoyl-N-(5-chlorothiazol-2-yl)amide
  • Amides
  • Antiviral Agents
  • Glucuronides
  • Prodrugs
  • Salicylamides
  • Thiazoles