A New Complex Design of Fe (II) Isoleucine Dithiocarbamate as a Novel Anticancer and Antivirus against SARSCOV-2 (COVID-19)

Asian Pac J Cancer Prev. 2022 Sep 1;23(9):3113-3123. doi: 10.31557/APJCP.2022.23.9.3113.

Abstract

Background: This study was carried out to synthesize a new complex of Fe(II) with isoleucine dithiocarbamate ligand and to determine its potential as an anticancer and antiviral agent for SARSCOV-2.

Methods: The synthesized complexes were then characterized by UV-vis and FT-IR spectroscopy and their melting points. The value of the conductivity of the complex compound is also determined. Anti-cancer activity was tested in vitro and molecular docking. Its potential as an antiviral against SARSCOV-2 was also carried out by molecular docking. Pharmacokinetics/ADMET properties were also carried out on the complex.

Result: Spectral results showed the successful synthesis of Fe(II) isoleucine dithiocarbamate complex. The complex produced UV-vis spectra at 268 and 575 nm, and the IR data at 399-599 cm-1 showed the coordination between the Fe(II) atoms with sulphur, nitrogen and oxygen of the isoleucine dithiocarbamate ligand. Fe(II) isoleucine dithiocarbamate had a cytotoxicity effect on the MCF-7 cell line (IC50 =613 µg/mL). The complex significantly caused morphological changes in the breast cancer cell line, finally leading to cell apoptosis.

Conclusion: Cytotoxic test of Fe(II) isoleucine dithiocarbamate showed moderate anticancer activity on MCF-7 cancer cells and showed antiviral activity against SARSCOV-2 by interfering with spike glycoprotein -ACE2 receptors, and inhibiting major proteases and 3Clpro.

Keywords: Complex; Dithiocarbamate; Fe(II); Isoleucine; MCF-7 cell lines.

MeSH terms

  • Angiotensin-Converting Enzyme 2
  • Antineoplastic Agents* / chemistry
  • Antiviral Agents / pharmacology
  • COVID-19 Drug Treatment*
  • Coordination Complexes* / pharmacology
  • Ferrous Compounds
  • Humans
  • Isoleucine
  • Ligands
  • Molecular Docking Simulation
  • Nitrogen
  • Oxygen
  • Spectroscopy, Fourier Transform Infrared
  • Sulfur

Substances

  • Antineoplastic Agents
  • Antiviral Agents
  • Coordination Complexes
  • Ferrous Compounds
  • Ligands
  • Isoleucine
  • Sulfur
  • Angiotensin-Converting Enzyme 2
  • Nitrogen
  • Oxygen