Olanzapine inhibits glycogen synthase kinase-3beta: an investigation by docking simulation and experimental validation

Eur J Pharmacol. 2008 Apr 14;584(1):185-91. doi: 10.1016/j.ejphar.2008.01.019. Epub 2008 Jan 30.

Abstract

Olanzapine was investigated as an inhibitor of glycogen synthase kinase-3beta (GSK-3beta) in an attempt to evaluate its effect on blood glucose level. The investigation included simulated docking experiments to fit olanzapine within the binding pocket of GSK-3beta followed by in vitro enzyme inhibition assay as well as in vivo subchronic animal treatment. Olanzapine was found to readily fit within the binding pocket of GSK-3beta in a low energy orientation characterized with optimal attractive interactions bridging the tricyclic thienobenzodiazepine nitrogen and sulfur atoms of olanzapine and the residue of VAL-135 of GSK-3beta. In vivo experiments showed a significant decrease in fasting blood glucose level in Balb/c mice at 1.0, 2.0 and 3.0 mg/kg dose levels (P<0.05) and 6 fold increase in liver glycogen level at the 3 mg/kg dose level (P<0.001). Moreover; olanzapine was found to potently inhibit recombinant GSK-3beta in vitro (IC(50) value=91.0 nM). Our findings strongly suggest that olanzapine has significant GSK-3beta inhibition activity that could justify some of its pharmacological effects and glucose metabolic disturbances.

Publication types

  • Research Support, Non-U.S. Gov't
  • Validation Study

MeSH terms

  • Animals
  • Antipsychotic Agents / chemistry
  • Antipsychotic Agents / metabolism
  • Antipsychotic Agents / pharmacology*
  • Benzodiazepines / chemistry
  • Benzodiazepines / metabolism
  • Benzodiazepines / pharmacology*
  • Binding Sites
  • Blood Glucose / drug effects
  • Computer Simulation*
  • Dose-Response Relationship, Drug
  • Glycogen / metabolism
  • Glycogen Synthase Kinase 3 / antagonists & inhibitors*
  • Glycogen Synthase Kinase 3 / chemistry
  • Glycogen Synthase Kinase 3 / metabolism
  • Glycogen Synthase Kinase 3 beta
  • Liver / drug effects
  • Liver / enzymology
  • Mice
  • Mice, Inbred BALB C
  • Models, Molecular*
  • Molecular Structure
  • Olanzapine
  • Pilot Projects
  • Protein Binding
  • Protein Conformation
  • Protein Kinase Inhibitors / chemistry
  • Protein Kinase Inhibitors / metabolism
  • Protein Kinase Inhibitors / pharmacology*
  • Recombinant Proteins / antagonists & inhibitors
  • Reproducibility of Results

Substances

  • Antipsychotic Agents
  • Blood Glucose
  • Protein Kinase Inhibitors
  • Recombinant Proteins
  • Benzodiazepines
  • Glycogen
  • Glycogen Synthase Kinase 3 beta
  • Gsk3b protein, mouse
  • Glycogen Synthase Kinase 3
  • Olanzapine