Derechos | Preview | Fecha Public. | Título | Autor(es) | Tipo |
openAccess | | 12-jul-2021 | AI in drug development: a multidisciplinary perspective | Gallego, Víctor; Naveiro Flores, Roi; Roca, Carlos CSIC ORCID; Ríos Insua, David ; Campillo, Nuria E. CSIC ORCID | artículo |
closedAccess | | 2018 | Chameleon-like behavior of indolylpiperidines in complex with cholinesterases targets: Potent butyrylcholinesterase inhibitors | Chierrito, Talita P. C.; Pedersoli-Mantoani, S.; Roca, Carlos CSIC ORCID; Sebastián-Pérez, Víctor; Martínez-González, Loreto CSIC ORCID ; Pérez, Daniel I. CSIC ORCID; Pérez, Concepción CSIC ORCID; Canales, Ángeles CSIC ORCID; Cañada, F. Javier ; Campillo, Nuria E. CSIC ORCID ; Carvalho, Ivone; Martínez Gil, Ana CSIC ORCID | artículo |
openAccess | | 2021 | Crystal structures of taxane-tubulin complexes: Implications for the mechanism of microtubule stabilization by Taxol | Prota, Andrea E.; Lucena-Agell, Daniel CSIC ORCID ; Ma, Yuntao; Estévez-Gallego, Juan CSIC ORCID ; Roca, Carlos CSIC ORCID; Josa-Prado, Fernando CSIC ORCID; Goossens, Kenneth; Giménez-Abián, Juan F. CSIC ; Li, Shuo; Canales, Ángeles CSIC ORCID; Bargsten, Katja; Andreu, José Manuel CSIC ORCID ; Altmann, Karl-Heinz; Olieric, Natacha; Kamimura, Shinji; Mühlethaler, Tobias; Oliva, María A. CSIC ORCID ; Steinmetz, Michel O.; Fang, Wei-Shuo; Díaz, José Fernando CSIC ORCID | preprint |
closedAccess | | 2018 | Deciphering the Inhibition of the Neuronal Calcium Sensor 1 and the Guanine Exchange Factor Ric8a with a Small Phenothiazine Molecule for the Rational Generation of Therapeutic Synapse Function Regulators | Roca, Carlos CSIC ORCID; Martínez-González, Loreto CSIC ORCID ; Daniel-Mozo, Miguel CSIC ORCID; Sastre, J. CSIC; Infantes, L. CSIC ORCID; Mansilla, A.; Chaves Sanjuán, Antonio CSIC ORCID; González-Rubio, Juana M. CSIC; Gil, C CSIC ORCID; Cañada, F. Javier ; Martínez, A.; Sánchez-Barrena, María José CSIC ORCID; Campillo, Nuria E. CSIC ORCID | artículo |
openAccess | | 20-oct-2017 | From dual binding site acetylcholinesterase inhibitors to allosteric modulators: A new avenue for disease-modifying drugs in Alzheimer's disease | Chierrito, Talita P. C.; Roca, Carlos CSIC ORCID; Requena-Triguero, Carlos CSIC ORCID; Sebastián-Pérez, Víctor; Pérez, Concepción CSIC ORCID; Jiménez-Barbero, Jesús CSIC ORCID; Cañada, F. Javier ; Campillo, Nuria E. CSIC ORCID ; Martínez Gil, Ana CSIC ORCID ; Carvalho, Ivone | artículo |
closedAccess | | 2019 | From simple quinoxalines to potent oxazolo[5,4-: F] quinoxaline inhibitors of glycogen-synthase kinase 3 (GSK3) | Lassagne, F.; Duguépéroux, C.; Roca, Carlos CSIC ORCID; Pérez, Concepción CSIC ORCID; Martínez Gil, Ana CSIC ORCID ; Baratte, B.; Robert, T.; Ruchaud, S.; Bach, S.; Erb, W.; Roisnel, T.; Mongin, F. | artículo |
openAccess | | 14-sep-2020 | Glycogen synthase kinase 3 (GSK-3) inhibitors: a patent update (2016–2019) | Roca, Carlos CSIC ORCID; Campillo, Nuria E. CSIC ORCID | artículo |
openAccess | | 28-dic-2018 | Highly potent and selective aryl-1,2,3-triazolyl benzylpiperidine inhibitors toward butyrylcholinesterase in Alzheimer's disease | De Andrade, Peterson; Mantoani, Susimaire P.; Gonçalves Nunes, Paulo Sérgio; Roca, Carlos CSIC ORCID; Pérez, Concepción CSIC ORCID; Xavier, Danilo Jordão; Hojo, Elza Tiemi Sakamoto; Campillo, Nuria E. CSIC ORCID ; Martínez Gil, Ana CSIC ORCID ; Carvalho, Ivone | artículo |
openAccess | | 25-may-2017 | Hybridizing feature selection and feature learning approaches in QSAR modeling for drug discovery | Ponzoni, Ignacio; Sebastián-Pérez, Víctor; Requena-Triguero, Carlos CSIC ORCID; Roca, Carlos CSIC ORCID; Páez, Juan A. CSIC ORCID; Campillo, Nuria E. CSIC ORCID | artículo |
openAccess | | dic-2018 | Identification of new allosteric sites and modulators of AChE through computational and experimental tools | Roca, Carlos CSIC ORCID; Requena-Triguero, Carlos CSIC ORCID; Sebastián-Pérez, Víctor; Malhotra, Sony; Radoux, Chris; Pérez, Concepción CSIC ORCID; Martínez Gil, Ana CSIC ORCID ; Páez, Juan A. CSIC ORCID; Blundell, Tom L.; Campillo, Nuria E. CSIC ORCID | artículo |
closedAccess | | 2019 | Indazolylketones as new multitarget cannabinoid drugs | González-Naranjo, Pedro CSIC ORCID; Pérez-Macías, Natalia CSIC ORCID; Pérez, Concepción CSIC ORCID; Roca, Carlos CSIC ORCID; Vaca, Gabriela; Girón, Rocío CSIC ORCID; Sánchez-Robles, E. M. CSIC ORCID; Martín-Fontelles, M. I.; Ceballos, María L. de CSIC ORCID; Martín-Requero, Ángeles CSIC ORCID ; Campillo, Nuria E. CSIC ORCID ; Páez, Juan A. CSIC ORCID | artículo |
openAccess | | 16-ago-2017 | Medicinal and biological chemistry (MBC) library: an efficient source on new hits | Sebastián-Pérez, Víctor; Roca, Carlos CSIC ORCID; Awale, Mahendra; Reymond, Jean-Louis; Martínez Gil, Ana CSIC ORCID ; Gil, Carmen CSIC ORCID ; Campillo, Nuria E. CSIC ORCID | artículo |
openAccess | | sep-2019 | Multitarget triazoles: an innovative approach for the treatment of Alzheimer’s disease | Nozal, Vanesa CSIC ORCID; García-Rubia, Alfonso CSIC; Roca, Carlos CSIC ORCID; Pérez, Concepción CSIC ORCID; Palomo, Valle CSIC ORCID ; Martínez Gil, Ana CSIC ORCID | comunicación de congreso |
openAccess | | 6-sep-2022 | Multitask deep neural networks for ames mutagenicity prediction | Martínez, María Jimena; Sabando, María Virginia; Soto, Axel J.; Roca, Carlos CSIC ORCID; Requena-Triguero, Carlos CSIC ORCID; Campillo, Nuria E. CSIC ORCID ; Páez, Juan A. CSIC ORCID; Ponzoni, Ignacio | artículo |
openAccess | | 20-jul-2019 | New protein-protein interaction modulators for the therapeutic regulation of synapse dysfunction in neurodevelopmental disorders and neurodegeneration | Mansilla, Alicia CSIC ORCID; Chaves Sanjuán, Antonio CSIC ORCID; Roca, Carlos CSIC ORCID; Canal-Martín, Andrea CSIC ORCID; Daniel-Mozo, Miguel CSIC ORCID; Martínez-González, Loreto CSIC ORCID ; Infantes, L. CSIC ORCID; Ferrús, Alberto CSIC ORCID; Martínez, A.; Pérez-Fernández, Ruth CSIC ORCID ; Campillo, Nuria E. CSIC ORCID ; Sánchez-Barrena, María José CSIC ORCID | comunicación de congreso |
openAccess | | 24-jun-2019 | QSAR classification models for predicting the activity of inhibitors of beta-secretase (BACE1) associated with Alzheimer's disease | Ponzoni, Ignacio; Sebastián-Pérez, Víctor; Martínez, María J.; Roca, Carlos CSIC ORCID; de la Cruz Pérez, Carlos; Cravero, Fiorella; Vazquez, Gustavo Esteban; Páez, Juan A. CSIC ORCID; Díaz, Mónica Fátima; Campillo, Nuria E. CSIC ORCID | artículo |
closedAccess | | 2017 | Subtly modulating glycogen synthase kinase 3 ß: Allosteric inhibitor development and their potential for the treatment of chronic diseases | Palomo, Valle CSIC ORCID ; Pérez, Daniel I. CSIC ORCID; Roca, Carlos CSIC ORCID; Anderson, Cara; Rodríguez-Muela, Natalia; Pérez, Concepción CSIC ORCID; Morales-García, José A. CSIC ORCID; Reyes Rodríguez, Julio Alberto; Campillo, Nuria E. CSIC ORCID ; Pérez Castillo, Ana CSIC ORCID; Rubin, Lee L.; Timchenko, Lubov; Gil, Carmen CSIC ORCID ; Martínez Gil, Ana CSIC ORCID | artículo |
closedAccess | | 2018 | Tau-Centric Multitarget Approach for Alzheimer's Disease: Development of First-in-Class Dual Glycogen Synthase Kinase 3β and Tau-Aggregation Inhibitors | Gandini, A.; Bartolini, M.; Tedesco, D.; Martínez-González, Loreto CSIC ORCID ; Roca, Carlos CSIC ORCID; Campillo, Nuria E. CSIC ORCID ; Zaldívar-Díez, Josefa CSIC ORCID; Pérez, Concepción CSIC ORCID; Zuccheri, G.; Miti, Andrea; Feoli, A.; Castellano, S.; Petralla, Sabrina; Monti, B.; Rossi, M.; Moda, F.; Legname, G.; Martínez Gil, Ana CSIC ORCID ; Bolognesi, Maria Laura | artículo |
openAccess | | 2018 | Técnicas computacionales aplicadas al descubrimiento de neurofármacos | Roca, Carlos CSIC ORCID | tesis doctoral |