Design, Synthesis, and Biological Evaluation for First GPX4 and CDK Dual Inhibitors

Jiangmin Zhu1, Yuxing Cai1, Min Kong1

  • 1Jiangsu Key Laboratory of Bioactive Natural Product Research, State Key Laboratory of Natural Medicines, Department of Natural Medicinal Chemistry, China Pharmaceutical University, 24 Tong Jia Xiang, Nanjing 210009, People's Republic of China.

PubMed

Insights

Researchers developed a dual inhibitor targeting ferroptosis and cell cycle progression for cancer therapy. Compound B9 effectively inhibits glutathione peroxidase 4 (GPX4) and cyclin-dependent kinases (CDKs), showing potent anticancer activity in vitro and in vivo.

Area of Science:

  • Oncology
  • Medicinal Chemistry
  • Molecular Biology

Background:

  • Combining ferroptosis and other cell death pathways offers therapeutic advantages for cancer treatment.
  • Synergistic anticancer effects observed between GPX4 inhibitors (ML162) and CDK inhibitors (indirubin-3'-oxime).

Purpose of the Study:

  • To design and synthesize novel dual inhibitors targeting both GPX4 and CDKs.
  • To evaluate the anticancer potential of these dual inhibitors.

Main Methods:

  • Synthesis of a series of GPX4 and CDK dual inhibitors.
  • In vitro cytotoxicity assays against multiple cancer cell lines.
  • Enzyme inhibition assays for GPX4 and CDK 4/6.
  • Cell cycle analysis and ferroptosis induction studies.
  • In vivo efficacy studies in mouse models.

Main Results:

  • Compound B9 demonstrated significant cytotoxic activity across four cell lines.
  • B9 potently inhibited GPX4 (IC50 = 542.5 nM) and selectively CDK 4/6 (IC50 = 191.2/68.1 nM).
  • B9 induced both ferroptosis and G1 phase arrest in MDA-MB-231 and HCT-116 cells.
  • B9 exhibited superior in vivo cancer growth inhibition compared to single-target inhibitors.

Conclusions:

  • Dual inhibition of GPX4 and CDKs is a promising strategy for cancer therapy.
  • Compound B9 represents a potent dual inhibitor with significant therapeutic potential.
  • Further development of GPX4/CDK dual inhibitors could lead to effective malignant cancer treatments.