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RS-Predictor: A new tool for predicting sites of cytochrome P450-mediated metabolism applied to CYP 3A4

This article describes RegioSelectivity-Predictor (RS-Predictor), a new in silico method for generating predictive models of P450-mediated metabolism for drug-like compounds. Within this method, potential sites of metabolism (SOMs) are represented as “metabolophores”: A concept that describes the hi...

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Detalhes bibliográficos
Main Authors: Zaretzki, Jed, Bergeron, Charles, Rydberg, Patrik, Huang, Tao-wei, Bennett, Kristin P., Breneman, Curt M.
Formato: Artigo
Idioma:Inglês
Publicado em: 2011
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3144271/
https://ncbi.nlm.nih.gov/pubmed/21528931
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci2000488
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