A Workflow Combining Machine Learning with Molecular Simulations Uncovers Potential Dual-Target Inhibitors against BTK and JAK3

The drug development process suffers from low success rates and requires expensive and time-consuming procedures. The traditional one drug–one target paradigm is often inadequate to treat multifactorial diseases. Multitarget drugs may potentially address problems such as adverse reactions to drugs....

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Detalles Bibliográficos
Autores principales: Liu, Lu, Na, Risong, Yang, Lianjuan, Liu, Jixiang, Tan, Yingjia, Zhao, Xi, Huang, Xuri, Chen, Xuecheng
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10608827/
https://www.ncbi.nlm.nih.gov/pubmed/37894618
http://dx.doi.org/10.3390/molecules28207140

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