Polypharmacology in Drug Development: A Minireview of Current Technologies

ChemMedChem. 2016 Jun 20;11(12):1211-8. doi: 10.1002/cmdc.201600067. Epub 2016 May 6.

Abstract

Polypharmacology, the process in which a single drug is able to bind to multiple targets specifically and simultaneously, is an emerging paradigm in drug development. The potency of a given drug can be increased through the engagement of multiple targets involved in a certain disease. Polypharmacology may also help identify novel applications of existing drugs through drug repositioning. However, many problems and challenges remain in this field. Rather than covering all aspects of polypharmacology, this Minireview is focused primarily on recently reported techniques, from bioinformatics technologies to cheminformatics approaches as well as text-mining-based methods, all of which have made significant contributions to the research of polypharmacology.

Keywords: bioinformatics; cheminformatics; drug development; polypharmacology.

Publication types

  • Review

MeSH terms

  • Binding Sites
  • Computational Biology
  • Humans
  • Ligands
  • Molecular Docking Simulation
  • Polypharmacology*
  • Quantitative Structure-Activity Relationship
  • Software

Substances

  • Ligands