Methotrexate-based PROTACs as DHFR-specific chemical probes

Cell Chem Biol. 2024 Feb 15;31(2):221-233.e14. doi: 10.1016/j.chembiol.2023.09.014. Epub 2023 Oct 23.

Abstract

Methotrexate (MTX) is a tight-binding dihydrofolate reductase (DHFR) inhibitor, used as both an antineoplastic and immunosuppressant therapeutic. MTX, like folate undergoes folylpolyglutamate synthetase-mediated γ-glutamylation, which affects cellular retention and target specificity. Mechanisms of MTX resistance in cancers include a decrease in MTX poly-γ-glutamylation and an upregulation of DHFR. Here, we report a series of potent MTX-based proteolysis targeting chimeras (PROTACs) to investigate DHFR degradation pharmacology and one-carbon biochemistry. These on-target, cell-active PROTACs show proteasome- and E3 ligase-dependent activity, and selective degradation of DHFR in multiple cancer cell lines. By comparison, treatment with MTX increases cellular DHFR protein expression. Importantly, these PROTACs produced distinct, less-lethal phenotypes compared to MTX. The chemical probe set described here should complement conventional DHFR inhibitors and serve as useful tools for studying one-carbon biochemistry and dissecting complex polypharmacology of MTX and related drugs. Such compounds may also serve as leads for potential autoimmune and antineoplastic therapeutics.

Keywords: DHFR-HiBiT; MTX-Cy5; PROTAC; antifolates; dihydrofolate reductase; methotrexate; one-carbon metabolism; targeted protein degradation; thymidylate synthase.

MeSH terms

  • Antineoplastic Agents* / pharmacology
  • Antineoplastic Agents* / therapeutic use
  • Carbon
  • Folic Acid Antagonists* / chemistry
  • Folic Acid Antagonists* / metabolism
  • Folic Acid Antagonists* / pharmacology
  • Folic Acid Antagonists* / therapeutic use
  • Humans
  • Methotrexate / metabolism
  • Methotrexate / pharmacology
  • Methotrexate / therapeutic use
  • Neoplasms* / drug therapy
  • Proteolysis Targeting Chimera
  • Tetrahydrofolate Dehydrogenase / metabolism

Substances

  • Antineoplastic Agents
  • Carbon
  • Folic Acid Antagonists
  • Methotrexate
  • Proteolysis Targeting Chimera
  • Tetrahydrofolate Dehydrogenase