Covalent binders in drug discovery

Prog Med Chem. 2019:58:1-62. doi: 10.1016/bs.pmch.2018.12.002. Epub 2019 Mar 11.

Abstract

Covalent modulation of protein function can have multiple utilities including therapeutics, and probes to interrogate biology. While this field is still viewed with scepticism due to the potential for (idiosyncratic) toxicities, significant strides have been made in terms of understanding how to tune electrophilicity to selectively target specific residues. Progress has also been made in harnessing the potential of covalent binders to uncover novel biology and to provide an enhanced utility as payloads for Antibody Drug Conjugates. This perspective covers the tenets and applications of covalent binders.

Keywords: Activity-based protein profiling; Antibody drug conjugates; Bioorthogonal chemistry; Computer aided drug design; Covalent drugs; Photoaffinity labelling; Targeted covalent inhibition.

MeSH terms

  • Aminoglycosides / chemistry
  • Aminoglycosides / metabolism
  • Benzodiazepines / chemistry
  • Benzodiazepines / metabolism
  • Camptothecin / chemistry
  • Camptothecin / metabolism
  • Drug Discovery*
  • Indoles / chemistry
  • Indoles / metabolism
  • Molecular Dynamics Simulation
  • Protein Binding
  • Proteins / chemistry*
  • Proteins / metabolism
  • Pyrans / chemistry
  • Pyrans / metabolism
  • Pyrroles / chemistry
  • Pyrroles / metabolism

Substances

  • Aminoglycosides
  • Indoles
  • Proteins
  • Pyrans
  • Pyrroles
  • pyrrolo(2,1-c)(1,4)benzodiazepine
  • Benzodiazepines
  • Camptothecin