Allosteric Inhibitors of the SARS-COV-2 Papain-like Protease Domain Induce Proteasomal Degradation of Its Parent Protein NSP3.
Peter E CockramBenjamin T WaltersAaron LictaoFrances ShanahanIngrid E WertzScott A FosterJoachim RudolphPublished in: ACS chemical biology (2023)
The papain-like protease of SARS-COV-2 is essential for viral replication and pathogenesis. Its location within a much larger multifunctional protein, NSP3, makes it an ideal candidate for a targeted degradation approach capable of eliminating multiple functions with a single-molecule treatment. In this work, we have developed a HiBiT-based cellular model to study NSP3 degradation and used this platform for the discovery of monovalent NSP3 degraders. We present previously unreported degradation activity of published papain-like protease inhibitors. Follow-up exploration of structure-activity relationships and mechanism-of-action studies points to the recruitment of the ubiquitin-proteasome machinery that is solely driven by site occupancy, regardless of molecular features of the ligand. Supported by HDX data, we hypothesize that binding-induced structural changes in NSP3 trigger the recruitment of an E3 ligase and lead to proteasomal degradation.
Keyphrases
- sars cov
- single molecule
- small molecule
- respiratory syndrome coronavirus
- protein protein
- high throughput
- binding protein
- randomized controlled trial
- systematic review
- electronic health record
- living cells
- atomic force microscopy
- machine learning
- oxidative stress
- diabetic rats
- deep learning
- single cell
- smoking cessation