Development and Experimental Validation of Regularized Machine Learning Models Detecting New, Structurally Distinct Activators of PXR

The pregnane X receptor (PXR) regulates the metabolism of many xenobiotic and endobiotic substances. In consequence, PXR decreases the efficacy of many small-molecule drugs and induces drug-drug interactions. The prediction of PXR activators with theoretical approaches such as machine learning (ML)...

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Detalles Bibliográficos
Autores principales: Hirte, Steffen, Burk, Oliver, Tahir, Ammar, Schwab, Matthias, Windshügel, Björn, Kirchmair, Johannes
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9029776/
https://www.ncbi.nlm.nih.gov/pubmed/35455933
http://dx.doi.org/10.3390/cells11081253

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9029776/
https://www.ncbi.nlm.nih.gov/pubmed/35455933
http://dx.doi.org/10.3390/cells11081253

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