Identification of a Novel Selective Serotonin Reuptake Inhibitor by Coupling Monoamine Transporter-Based Virtual Screening and Rational Molecular Hybridization

[Image: see text] Ligand virtual screening (VS) using the vestibular binding pocket of a three-dimensional (3-D) monoamine transporter (MAT) computational model followed by in vitro pharmacology led to the identification of a human serotonin transporter (hSERT) inhibitor with modest affinity (hSERT...

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Hlavní autoři: Nolan, Tammy L., Lapinsky, David J., Talbot, Jeffery N., Indarte, Martín, Liu, Yi, Manepalli, Sankar, Geffert, Laura M., Amos, Mary Ellen, Taylor, Phillip N., Madura, Jeffry D., Surratt, Christopher K.
Médium: Artigo
Jazyk:Inglês
Vydáno: American Chemical Society 2011
On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC3181111/
https://ncbi.nlm.nih.gov/pubmed/21966587
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/cn200044x
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