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openAccesscomputationalstructuralbiotechnologyjournal_gupta_2021.pdf.jpg4-jun-2021A fragment-based approach to assess the ligandability of ArgB, ArgC, ArgD and ArgF in the L-arginine biosynthetic pathway of Mycobacterium tuberculosisGupta, Pooja; Thomas, Sherine E.; Zaidan, Shaymaa A.; Pasillas, María A.; Cory-Wright, James; Sebastián-Pérez, Víctor; Burgess, Ailidh; Cattermole, Emma; Meghir, Clio; Abell, Chris; Coyne, Anthony G.; Jacobs Jr, William R.; Blundell, Tom L.; Tiwari, Sangeeta; Mendes, Vítorartículo
openAccessantibiotics_straniero_2020.pdf.jpg4-abr-2020Benzamide derivatives targeting the cell division protein FtsZ: modifications of the linker and the benzodioxane scaffold and their effects on antimicrobial activityStraniero, Valentina; Suigo, Lorenzo; Casiraghi, Andrea; Sebastián-Pérez, Víctor; Hrast, Martina; Zanotto, Carlo; Zdovc, Irena; de Giuli-Morghen, Carlo; Radaelli, Antonia; Valoti, Ermannoartículo
closedAccessrestringido.pdf.jpg21-nov-2019Benzodioxane-benzamides as antibacterial agents: computational and SAR studies to evaluate the influence of the 7-substitution in FtsZ interactionStraniero, Valentina; Sebastián-Pérez, Víctor; Hrast, Martina; Zanotto, Carlo; Casiraghi, Andrea; Suigo, Lorenzo; Zdovc, Irena; Radaelli, Antonia; de Giuli-Morghen, Carlo; Valoti, Ermannoartículo
closedAccessaccesoRestringido.pdf.jpg2018Chameleon-like behavior of indolylpiperidines in complex with cholinesterases targets: Potent butyrylcholinesterase inhibitorsChierrito, 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
openAccessES2696516A1.pdf.jpg16-ene-2019Compuestos derivados de piperidina como inhibidores de PDE8AGil, Carmen CSIC ORCID ; Martínez Gil, Ana CSIC ORCID ; Sebastián-Pérez, Víctor; Herrera Díaz; Julie Catherinesolicitud de patente
openAccessES2696516B2.pdf.jpg16-ene-2019Compuestos derivados de piperidina como inhibidores de PDE8AGil, Carmen CSIC ORCID ; Martínez Gil, Ana CSIC ORCID ; Sebastián-Pérez, Víctor; Herrera Díaz; Julie Catherinepatente
openAccessantibiotics_straniero_2021.pdf.jpg15-abr-2021Computational design and development of benzodioxane-benzamides as potent inhibitors of FtsZ by exploring the hydrophobic subpocketStraniero, Valentina; Sebastián-Pérez, Víctor; Suigo, Lorenzo; Margolin, William; Casiraghi, Andrea; Hrast, Martina; Zanotto, Carlo; Zdovc, Irena; Radaelli, Antonia; Valoti, Ermannoartículo
openAccessJEIMC_Sciú_2018.pdf.jpg1-ene-2019Computer-aided molecular design of pyrazolotriazines targeting glycogen synthase kinase 3Sciú, María Lourdes; Sebastián-Pérez, Víctor; Martínez-González, Loreto CSIC ORCID ; Benítez, Rocio; Pérez, Daniel I. CSIC ORCID; Pérez, Concepción CSIC ORCID; Campillo, Nuria E. CSIC ORCID ; Martínez Gil, Ana CSIC ORCID ; Moyano, Elizabeth Lauraartículo
openAccessAntimicrob. Agents Chemother.-2018-Sebastián-Pérez-AAC.00603-18.pdf.jpg13-ago-2018Cyclic nucleotide specific phosphodiesterases as potential drug targets for anti-Leishmania therapySebastián-Pérez, Víctor; Hendrickx, Sarah; Munday, Jane C.; Kalejaiye, Titilola; Martínez Gil, Ana CSIC ORCID ; Campillo, Nuria E. CSIC ORCID ; Koning, Harry de; Caljon, Guy; Maes, Louis; Gil, Carmen CSIC ORCID artículo
openAccessJournal of Enzyme Inhibition and Medicinal Chemistry_Sebastián-Pérez_ 2020.pdf.jpgdic-2020Deciphering the enzymatic target of a new family of antischistosomal agents bearing a quinazoline scaffold using complementary computational toolsSebastián-Pérez, Víctor; García-Rubia, Alfonso CSIC; Seif el-Din, Sayed H.; Sabra, Abdel-Nasser A.; El-Lakkany, Naglaa M.; William, Samia; Blundell, Tom L.; Maes, Louis; Martínez Gil, Ana CSIC ORCID ; Campillo, Nuria E. CSIC ORCID ; Botros, Sanaa S.; Gil, Carmen CSIC ORCID artículo
openAccesssci2021_straniero_abstract.pdf.jpgsep-2021Development of benzodioxane-benzamides inhibitors of FtsZ as potent broad-spectrum antimicrobial agentsStraniero, Valentina; Suigo, Lorenzo; Sebastián-Pérez, Víctor; Margolin, William; Sobrinos-Sanguino, Marta CSIC ORCID ; Zanotto, Carlo; Monterroso, Begoña CSIC ORCID ; Hrast, Martina; Zorrilla, Silvia CSIC ORCID ; Rivas, Germán CSIC ORCID CVN ; Valoti, Ermannocomunicación de congreso
openAccessAAC_Sebastián-Pérez_2021.pdf.jpg20-ene-2021Discovery of amoebicidal compounds by combining computational and experimental approachesSebastián-Pérez, Víctor; Sifaoui, Ines; Reyes-Batlle, María; Domínguez-De Barros, Angélica; López-Arencibia, A.; Campillo, Nuria E. CSIC ORCID ; Piñero, J. E.; Lorenzo-Morales, Jacob; Gil, Carmen CSIC ORCID artículo
openAccessFuture Med Chem_Sebastián-Pérez_2019.pdf.jpg2-ago-2019Discovery of novel Schistosoma mansoni PDE4A inhibitors as potential agents against schistosomiasisSebastián-Pérez, Víctor; Schroeder, Susanne; Munday, Jane C.; Meer, Tiffany van der; Zaldívar-Díez, Josefa CSIC ORCID; Siderius, Marco; Koning, Harry de; Martínez Gil, Ana CSIC ORCID ; Campillo, Nuria E. CSIC ORCID ; Leurs, Rob; Gil, Carmen CSIC ORCID artículo
openAccess20-oct-2017From dual binding site acetylcholinesterase inhibitors to allosteric modulators: A new avenue for disease-modifying drugs in Alzheimer's diseaseChierrito, 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, Ivoneartículo
openAccessSc. Rep.2017.pdf.jpg25-may-2017Hybridizing feature selection and feature learning approaches in QSAR modeling for drug discoveryPonzoni, Ignacio; Sebastián-Pérez, Víctor; Requena-Triguero, Carlos CSIC ORCID; Roca, Carlos CSIC ORCID; Páez, Juan A. CSIC ORCID; Campillo, Nuria E. CSIC ORCID artículo
openAccessJEIMC_2018.pdf.jpgdic-2018Identification of new allosteric sites and modulators of AChE through computational and experimental toolsRoca, 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
openAccessAAC_de Araujo J.S._2019.pdf.jpg27-mar-2019Imidazole derivatives as promising agents for the treatment of chagas diseaseSiciliano de Araujo, Julianna; García-Rubia, Alfonso CSIC; Sebastián-Pérez, Víctor; Kalejaiye, Titilola; da Silva, P. B.; Fonseca-Berzal, Cristina; Maes, Louis; Koning, Harry de; de Nazaré Correia Soeiro, Maria; Gil, Carmen CSIC ORCID artículo
openAccessJCIM 2017.pdf.jpg16-ago-2017Medicinal and biological chemistry (MBC) library: an efficient source on new hitsSebastián-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
openAccessEJMECH_N. Campillo.pdf.jpg30-jun-2016New applications for known drugs: Human glycogen synthase kinase 3 inhibitors as modulators of Aspergillus fumigatus growthSebastián-Pérez, Víctor; Manoli, Maria-Tsampika CSIC ORCID ; Pérez, Daniel I. CSIC ORCID; Gil, Carmen CSIC ORCID ; Mellado, Emilia; Martínez Gil, Ana CSIC ORCID ; Espeso, Eduardo A. CSIC ORCID ; Campillo, Nuria E. CSIC ORCID artículo
openAccessWO2019012173A1.pdf.jpg17-ene-2019Piperidine-derived compounds as pde8a inhibitorsGil, Carmen CSIC ORCID ; Martínez Gil, Ana CSIC ORCID ; Sebastián-Pérez, Víctor; Herrera Díaz; Julie Catherinesolicitud de patente