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C@PA: Computer-Aided Pattern Analysis to Predict Multitarget ABC Transporter Inhibitors
[Image: see text] Based on literature reports of the last two decades, a computer-aided pattern analysis (C@PA) was implemented for the discovery of novel multitarget ABCB1 (P-gp), ABCC1 (MRP1), and ABCG2 (BCRP) inhibitors. C@PA included basic scaffold identification, substructure search and statist...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical
Society
2021
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8041314/ https://www.ncbi.nlm.nih.gov/pubmed/33724808 http://dx.doi.org/10.1021/acs.jmedchem.0c02199 |