Potential repurposing of four FDA approved compounds with antiplasmodial activity identified through proteome scale computational drug discovery and in vitro assay

Malaria elimination can benefit from time and cost-efficient approaches for antimalarials such as drug repurposing. In this work, 796 DrugBank compounds were screened against 36 Plasmodium falciparum targets using QuickVina-W. Hits were selected after rescoring using GRaph Interaction Matching (GRIM...

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Detalles Bibliográficos
Autores principales: Diallo, Bakary N’tji, Swart, Tarryn, Hoppe, Heinrich C., Tastan Bishop, Özlem, Lobb, Kevin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2021
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7809352/
https://www.ncbi.nlm.nih.gov/pubmed/33446838
http://dx.doi.org/10.1038/s41598-020-80722-2

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