論文

査読有り 国際誌
2020年6月

Chemoproteomic Profiling of a Pharmacophore-Focused Chemical Library

Cell Chemical Biology
  • Louvy Lynn Punzalan
  • Lulu Jiang
  • Di Mao
  • Amarjyoti Das Mahapatra
  • Shinichi Sato
  • Yasushi Takemoto
  • Mari Tsujimura
  • Kosuke Kusamori
  • Makiya Nishikawa
  • Lu Zhou
  • Motonari Uesugi
  • 全て表示

27
6
開始ページ
708
終了ページ
718.e10
記述言語
英語
掲載種別
研究論文(学術雑誌)
DOI
10.1016/j.chembiol.2020.04.007
出版者・発行元
Elsevier BV

Pharmacophore-focused chemical libraries are continuously being created in drug discovery programs, yet screening assays to maximize the usage of such libraries are not fully explored. Here, we report a chemical proteomics approach to reutilizing a focused chemical library of 1,800 indole-containing molecules for discovering uncharacterized ligand-protein pairs. Gel-based protein profiling of the library using a photo-affinity indole probe 1 enabled us to find new ligands for glyoxalase 1 (Glo1), an enzyme involved in the detoxification of methylglyoxal. Structure optimization of the ligands yielded an inhibitor for Glo1 (9). Molecule 9 increased the cellular methylglyoxal levels in human cells and suppressed the osteoclast formation of mouse bone marrow-derived macrophages. X-ray structure analyses revealed that the molecule lies at a site abutting the substrate binding site, which is consistent with the enzyme kinetic profile of 9. Overall, this study exemplifies how chemical proteomics can be used to exploit existing focused chemical libraries.

リンク情報
DOI
https://doi.org/10.1016/j.chembiol.2020.04.007
PubMed
https://www.ncbi.nlm.nih.gov/pubmed/32402240
ID情報
  • DOI : 10.1016/j.chembiol.2020.04.007
  • ISSN : 2451-9456
  • PubMed ID : 32402240

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