Ultra-High-Throughput Screening of Natural Product Extracts to Identify Proapoptotic Inhibitors of Bcl-2 Family Proteins

J Biomol Screen. 2014 Sep;19(8):1201-11. doi: 10.1177/1087057114536227. Epub 2014 May 27.

Abstract

Antiapoptotic Bcl-2 family proteins are validated cancer targets composed of six related proteins. From a drug discovery perspective, these are challenging targets that exert their cellular functions through protein-protein interactions (PPIs). Although several isoform-selective inhibitors have been developed using structure-based design or high-throughput screening (HTS) of synthetic chemical libraries, no large-scale screen of natural product collections has been reported. A competitive displacement fluorescence polarization (FP) screen of nearly 150,000 natural product extracts was conducted against all six antiapoptotic Bcl-2 family proteins using fluorochrome-conjugated peptide ligands that mimic functionally relevant PPIs. The screens were conducted in 1536-well format and displayed satisfactory overall HTS statistics, with Z'-factor values ranging from 0.72 to 0.83 and a hit confirmation rate between 16% and 64%. Confirmed active extracts were orthogonally tested in a luminescent assay for caspase-3/7 activation in tumor cells. Active extracts were resupplied, and effort toward the isolation of pure active components was initiated through iterative bioassay-guided fractionation. Several previously described altertoxins were isolated from a microbial source, and the pure compounds demonstrate activity in both Bcl-2 FP and caspase cellular assays. The studies demonstrate the feasibility of ultra-high-throughput screening using natural product sources and highlight some of the challenges associated with this approach.

Keywords: Bcl-2 family; apoptosis; bioassay-guided fractionation; fluorescence polarization; natural product extracts; ultra-high-throughput screening.

Publication types

  • Research Support, N.I.H., Extramural

MeSH terms

  • Biological Products / chemistry*
  • Caco-2 Cells
  • Caspase 3 / metabolism
  • Caspase 7 / metabolism
  • Drug Screening Assays, Antitumor / methods
  • Fluorescence Polarization / methods
  • High-Throughput Screening Assays / instrumentation
  • High-Throughput Screening Assays / methods*
  • Humans
  • Miniaturization
  • Molecular Targeted Therapy / methods
  • Mycotoxins / isolation & purification
  • Mycotoxins / pharmacology
  • Proto-Oncogene Proteins c-bcl-2 / antagonists & inhibitors*
  • Solid Phase Extraction
  • bcl-X Protein / antagonists & inhibitors

Substances

  • Biological Products
  • Mycotoxins
  • Proto-Oncogene Proteins c-bcl-2
  • bcl-X Protein
  • Caspase 3
  • Caspase 7