Discovery of Immunoproteasome Inhibitors Using Large-Scale Covalent Virtual Screening

Large-scale virtual screening of boronic acid derivatives was performed to identify nonpeptidic covalent inhibitors of the β5i subunit of the immunoproteasome. A hierarchical virtual screening cascade including noncovalent and covalent docking steps was applied to a virtual library of over 104,000 c...

Descripción completa

Detalles Bibliográficos
Autores principales: Scarpino, Andrea, Bajusz, Dávid, Proj, Matic, Gobec, Martina, Sosič, Izidor, Gobec, Stanislav, Ferenczy, György G., Keserű, György M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2019
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6680723/
https://www.ncbi.nlm.nih.gov/pubmed/31315311
http://dx.doi.org/10.3390/molecules24142590

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6680723/
https://www.ncbi.nlm.nih.gov/pubmed/31315311
http://dx.doi.org/10.3390/molecules24142590

Ejemplares similares