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Binding of Protein Kinase Inhibitors to Synapsin I Inferred from Pair-Wise Binding Site Similarity Measurements
Predicting off-targets by computational methods is getting increasing importance in early drug discovery stages. We herewith present a computational method based on binding site three-dimensional comparisons, which prompted us to investigate the cross-reaction of protein kinase inhibitors with synap...
Autores principales: | De Franchi, Enrico, Schalon, Claire, Messa, Mirko, Onofri, Franco, Benfenati, Fabio, Rognan, Didier |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
Public Library of Science
2010
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2922380/ https://www.ncbi.nlm.nih.gov/pubmed/20808948 http://dx.doi.org/10.1371/journal.pone.0012214 |
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