Investigation of carbonic anhydrase inhibitory effects and cytotoxicities of pyrazole-based hybrids carrying hydrazone and zinc-binding benzenesulfonamide pharmacophores

Bioorg Chem. 2022 Oct:127:105969. doi: 10.1016/j.bioorg.2022.105969. Epub 2022 Jun 14.

Abstract

Pyrazole-based carbohydrazone hybrids have been considered to be a remarkable class of compounds in pharmaceutical chemistry. Here, we reported bioactivities of 4-(3-(2-(arylidene)hydrazin-1-carbonyl)-5-phenyl-1H-pyrazol-1-yl)benzenesulfonamides (1-27) towards CA isoenzymes (hCA I, hCA II, hCA IX) and human oral squamous cell carcinoma cell line. Compounds 19 (Ki = 10.1 nM, hCA I/hCA IX = 749.6), 22 (Ki = 18.5 nM, hCA I/hCA IX = 429.2), 26 (Ki = 14.5 nM, hCA I/hCA IX = 596.9), 27 (Ki = 21.5 nM, hCA I/hCA IX = 413.1) were more potent and selective inhibitors of cancer-associated hCA IX isoenzyme. Compounds 22 and 26 were also found to be approximately three times more selective hCA IX inhibitors over off-target hCA II at low nanomolar. Compounds 19, 22, 23, 24, and 26 with IC50 of 1.6-1.7 μM showed potent cytotoxicity against human oral squamous cell carcinoma cell line as compared with human gingival fibroblast, producing the tumor-specificity value over 100. This was due to its cytostatic growth inhibition accompanied by a slight but significant dose-dependent increase in cell shrinkage and subG1 cell accumulation and marginal activation of caspase 3 substrates. Bioassay results showed that carbohydrazone-based hybrids could be useful candidates to design novel anticancer compounds and selective carbonic anhydrase inhibitors.

Keywords: Anticancer; Benzenesulfonamide; Carbohydrazone; Carbonic anhydrase; OSCC; Pyrazole; hCA IX.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Antigens, Neoplasm / metabolism
  • Benzenesulfonamides
  • Carbonic Anhydrase IX
  • Carbonic Anhydrase Inhibitors / chemistry
  • Carbonic Anhydrase Inhibitors / pharmacology
  • Carbonic Anhydrases* / metabolism
  • Carcinoma, Squamous Cell*
  • Head and Neck Neoplasms*
  • Humans
  • Hydrazones / pharmacology
  • Isoenzymes / metabolism
  • Molecular Structure
  • Mouth Neoplasms*
  • Pyrazoles / chemistry
  • Pyrazoles / pharmacology
  • Squamous Cell Carcinoma of Head and Neck
  • Structure-Activity Relationship
  • Sulfonamides
  • Zinc

Substances

  • Antigens, Neoplasm
  • Carbonic Anhydrase Inhibitors
  • Hydrazones
  • Isoenzymes
  • Pyrazoles
  • Sulfonamides
  • Carbonic Anhydrase IX
  • Carbonic Anhydrases
  • Zinc