Identification of Polo-like kinase 1 interaction inhibitors using a novel cell-based assay

Sci Rep. 2016 Nov 22:5:37581. doi: 10.1038/srep37581.

Abstract

Polo-like kinase 1 (Plk1) plays several roles in cell division and it is a recognized cancer drug target. Plk1 levels are elevated in cancer and several types of cancer cells are hypersensitive to Plk1 inhibition. Small molecule inhibitors of the kinase domain (KD) of Plk1 have been developed. Their selectivity is limited, which likely contributes to their toxicity. Polo-like kinases are characterized by a Polo-Box Domain (PBD), which mediates interactions with phosphorylation substrates or regulators. Inhibition of the PBD could allow better selectivity or result in different effects than inhibition of the KD. In vitro screens have been used to identify PBD inhibitors with mixed results. We developed the first cell-based assay to screen for PBD inhibitors, using Bioluminescence Resonance Energy Transfer (BRET). We screened through 112 983 compounds and characterized hits in secondary biochemical and biological assays. Subsequent Structure-Activity Relationship (SAR) analysis on our most promising hit revealed that it requires an alkylating function for its activity. In addition, we show that the previously reported PBD inhibitors thymoquinone and Poloxin are also alkylating agents. Our cell-based assay is a promising tool for the identification of new PBD inhibitors with more drug-like profiles using larger and more diverse chemical libraries.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Alkylating Agents / chemistry
  • Alkylating Agents / pharmacology
  • Benzoates / chemistry
  • Benzoates / pharmacology
  • Benzoquinones / chemistry
  • Benzoquinones / pharmacology
  • Bioluminescence Resonance Energy Transfer Techniques
  • Cell Cycle Proteins / antagonists & inhibitors*
  • HEK293 Cells
  • High-Throughput Screening Assays
  • Humans
  • Polo-Like Kinase 1
  • Protein Interaction Domains and Motifs
  • Protein Kinase Inhibitors / chemistry
  • Protein Kinase Inhibitors / pharmacology*
  • Protein Serine-Threonine Kinases / antagonists & inhibitors*
  • Proto-Oncogene Proteins / antagonists & inhibitors*
  • Quinones / chemistry
  • Quinones / pharmacology
  • Small Molecule Libraries / chemistry
  • Small Molecule Libraries / pharmacology
  • Structure-Activity Relationship

Substances

  • Alkylating Agents
  • Benzoates
  • Benzoquinones
  • Cell Cycle Proteins
  • Protein Kinase Inhibitors
  • Proto-Oncogene Proteins
  • Quinones
  • Small Molecule Libraries
  • poloxin
  • Protein Serine-Threonine Kinases
  • thymoquinone