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A Chemocentric Informatics Approach to Drug Discovery: Identification and Experimental Validation of Selective Estrogen Receptor Modulators as ligands of 5-Hydroxytryptamine-6 Receptors and as Potential Cognition Enhancers

We have devised a chemocentric informatics methodology for drug discovery integrating independent approaches to mining biomolecular databases. As a proof of concept, we have searched for novel putative cognition enhancers. First, we generated Quantitative Structure- Activity Relationship (QSAR) mode...

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Detalhes bibliográficos
Main Authors: Hajjo, Rima, Setola, Vincent, Roth, Bryan L., Tropsha, Alexander
Formato: Artigo
Idioma:Inglês
Publicado em: 2012
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3401608/
https://ncbi.nlm.nih.gov/pubmed/22537153
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jm2011657
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