Design and synthesis of novel uracil-linked Schiff bases as dual histone deacetylase type II/topoisomerase type I inhibitors with apoptotic potential

Future Med Chem. 2023 Jun;15(11):937-958. doi: 10.4155/fmc-2023-0112. Epub 2023 Jun 29.

Abstract

Aim: The previously reported dual histone deacetylase type II (HDAC II) / topoisomerase type I (Topo I) inhibitors suffer pharmacokinetic limitations because of their huge molecular weights. Materials & methods: We report the design and synthesis of a smarter novel set of uracil-linked Schiff bases (19-30) as dual HDAC II/Topo I inhibitors keeping the essential pharmacophoric features. Cytotoxicity of all compounds was assessed against three cancer cell lines. Studies of their effects on the apoptotic BAX and antiapoptotic BCL2 genes, molecular docking studies, and absorption, distribution, metabolism and excretion studies were conducted. Results: Compounds 22, 25 and 30 exhibited significant activities. The bromophenyl derivative 22 displayed the best selectivity index, with IC50 values against HDAC II and Topo I of 1.12 and 13.44 μM, respectively. Conclusion: Compound 22 could be considered a lead HDAC II/Topo I inhibitor.

Keywords: HDAC II; Schiff bases; Topo I; apoptotic markers; dual activity; uracil.

MeSH terms

  • Antineoplastic Agents* / pharmacology
  • Cell Line, Tumor
  • Cell Proliferation
  • DNA Topoisomerases, Type II / metabolism
  • DNA Topoisomerases, Type II / pharmacology
  • Histone Deacetylase Inhibitors* / pharmacology
  • Histone Deacetylases / metabolism
  • Molecular Docking Simulation
  • Schiff Bases / pharmacology
  • Structure-Activity Relationship
  • Topoisomerase I Inhibitors / pharmacology

Substances

  • Histone Deacetylase Inhibitors
  • Topoisomerase I Inhibitors
  • Histone Deacetylases
  • Schiff Bases
  • Antineoplastic Agents
  • DNA Topoisomerases, Type II