Characterization of non-nitrocatechol pan and isoform specific catechol-O-methyltransferase inhibitors and substrates

ACS Chem Neurosci. 2012 Feb 15;3(2):129-40. doi: 10.1021/cn200109w. Epub 2011 Nov 14.

Abstract

Reduced dopamine neurotransmission in the prefrontal cortex has been implicated as causal for the negative symptoms and cognitive deficit associated with schizophrenia; thus, a compound which selectively enhances dopamine neurotransmission in the prefrontal cortex may have therapeutic potential. Inhibition of catechol-O-methyltransferase (COMT, EC 2.1.1.6) offers a unique advantage, since this enzyme is the primary mechanism for the elimination of dopamine in cortical areas. Since membrane bound COMT (MB-COMT) is the predominant isoform in human brain, a high throughput screen (HTS) to identify novel MB-COMT specific inhibitors was completed. Subsequent optimization led to the identification of novel, non-nitrocatechol COMT inhibitors, some of which interact specifically with MB-COMT. Compounds were characterized for in vitro efficacy versus human and rat MB and soluble (S)-COMT. Select compounds were administered to male Wistar rats, and ex vivo COMT activity, compound levels in plasma and cerebrospinal fluid (CSF), and CSF dopamine metabolite levels were determined as measures of preclinical efficacy. Finally, novel non-nitrocatechol COMT inhibitors displayed less potent uncoupling of the mitochondrial membrane potential (MMP) compared to tolcapone as well as nonhepatotoxic entacapone, thus mitigating the risk of hepatotoxicity.

Keywords: Catechol-O-methyltransferase; dihydroxyphenylacetic acid; fluorescence polarization and hepatotoxicity; high throughput screen; homovanillic acid.

MeSH terms

  • Animals
  • Antipsychotic Agents / chemical synthesis
  • Antipsychotic Agents / pharmacokinetics*
  • Benzophenones / chemistry
  • Benzophenones / pharmacology
  • Biomarkers
  • Blotting, Western
  • Catechol O-Methyltransferase / isolation & purification
  • Catechol O-Methyltransferase / metabolism*
  • Catechol O-Methyltransferase Inhibitors*
  • Cell Membrane / enzymology
  • Cell Membrane / metabolism
  • Dopamine / metabolism
  • Enzyme Inhibitors / chemistry
  • Enzyme Inhibitors / pharmacology*
  • Humans
  • Isoenzymes / antagonists & inhibitors
  • Isoenzymes / isolation & purification
  • Isoenzymes / metabolism
  • Male
  • Matrix Metalloproteinases / metabolism
  • Membrane Potential, Mitochondrial / drug effects
  • Nitrophenols / chemistry
  • Nitrophenols / pharmacology
  • Rats
  • Rats, Sprague-Dawley
  • Rats, Wistar
  • Recombinant Proteins / chemistry
  • Schizophrenia / drug therapy
  • Substrate Specificity
  • Tolcapone

Substances

  • Antipsychotic Agents
  • Benzophenones
  • Biomarkers
  • Catechol O-Methyltransferase Inhibitors
  • Enzyme Inhibitors
  • Isoenzymes
  • Nitrophenols
  • Recombinant Proteins
  • Tolcapone
  • Catechol O-Methyltransferase
  • Matrix Metalloproteinases
  • Dopamine