Hit Identification of a Novel Dual Binder for h-telo/c-myc G-Quadruplex by a Combination of Pharmacophore Structure-Based Virtual Screening and Docking Refinement

It is well known that G‐quadruplexes are targets of great interest for their roles in crucial biological processes, such as aging and cancer. Hence, a promising strategy for anticancer drug therapy is the stabilization of these structures by small molecules. We report a high‐throughput in silico scr...

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Veröffentlicht in:	ChemMedChem 2016-08, Vol.11 (16), p.1721-1733
Hauptverfasser:	Rocca, Roberta, Costa, Giosuè, Artese, Anna, Parrotta, Lucia, Ortuso, Francesco, Maccioni, Elias, Pinato, Odra, Greco, Maria Laura, Sissi, Claudia, Alcaro, Stefano, Distinto, Simona, Moraca, Federica
Format:	Artikel
Sprache:	eng
Schlagworte:	circular dichroism Drug Evaluation, Preclinical FRET G-quadruplexes G-Quadruplexes - drug effects Genes, myc - drug effects Humans Molecular Docking Simulation molecular modeling Promoter Regions, Genetic - drug effects virtual screening
Online-Zugang:	Volltext
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