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From flamingo dance to (desirable) drug discovery: a nature-inspired approach.
Sánchez-Rodríguez A, Pérez-Castillo Y, Schürer SC, Nicolotti O, Mangiatordi GF, Borges F, Cordeiro MNDS, Tejera E, Medina-Franco JL, Cruz-Monteagudo M. Sánchez-Rodríguez A, et al. Among authors: nicolotti o. Drug Discov Today. 2017 Oct;22(10):1489-1502. doi: 10.1016/j.drudis.2017.05.008. Epub 2017 Jun 15. Drug Discov Today. 2017. PMID: 28624633 Free PMC article. Review.
Activity cliffs in drug discovery: Dr Jekyll or Mr Hyde?
Cruz-Monteagudo M, Medina-Franco JL, Pérez-Castillo Y, Nicolotti O, Cordeiro MN, Borges F. Cruz-Monteagudo M, et al. Among authors: nicolotti o. Drug Discov Today. 2014 Aug;19(8):1069-80. doi: 10.1016/j.drudis.2014.02.003. Epub 2014 Feb 20. Drug Discov Today. 2014. PMID: 24560935
Trimethoxybenzanilide-based P-glycoprotein modulators: an interesting case of lipophilicity tuning by intramolecular hydrogen bonding.
Tardia P, Stefanachi A, Niso M, Stolfa DA, Mangiatordi GF, Alberga D, Nicolotti O, Lattanzi G, Carotti A, Leonetti F, Perrone R, Berardi F, Azzariti A, Colabufo NA, Cellamare S. Tardia P, et al. Among authors: nicolotti o. J Med Chem. 2014 Aug 14;57(15):6403-18. doi: 10.1021/jm500697c. Epub 2014 Aug 5. J Med Chem. 2014. PMID: 25093931
A generalizable definition of chemical similarity for read-across.
Floris M, Manganaro A, Nicolotti O, Medda R, Mangiatordi GF, Benfenati E. Floris M, et al. Among authors: nicolotti o. J Cheminform. 2014 Oct 18;6(1):39. doi: 10.1186/s13321-014-0039-1. eCollection 2014 Dec. J Cheminform. 2014. PMID: 25383097 Free PMC article.
165 results