{"id":25159,"date":"2024-11-21T12:03:16","date_gmt":"2024-11-21T11:03:16","guid":{"rendered":"https:\/\/idibell.cat\/es\/?page_id=25159"},"modified":"2024-12-13T11:10:52","modified_gmt":"2024-12-13T10:10:52","slug":"quimica-medica-y-diseno-de-farmacos","status":"publish","type":"page","link":"https:\/\/idibell.cat\/es\/investigacion\/area-de-cancer\/programa-de-mecanismos-moleculares-y-terapia-experimental-en-oncologia-oncobell\/quimica-medica-y-diseno-de-farmacos\/","title":{"rendered":"Qu\u00edmica M\u00e9dica y Dise\u00f1o de F\u00e1rmacos"},"content":{"rendered":"\n<h1>\n\t\tQu\u00edmica m\u00e9dica y dise\u00f1o de f\u00e1rmacos\n\t<\/h1>\n<h3>\n\t\tResumen\n\t<\/h3>\n\t<p>El grupo de investigaci\u00f3n en qu\u00edmica m\u00e9dica y dise\u00f1o de f\u00e1rmacos es un grupo computacional y experimental que utiliza herramientas de qu\u00edmica org\u00e1nica, biolog\u00eda, y ciencia de datos para entender mejor el mecanismo de acci\u00f3n de los f\u00e1rmacos para utilizarlos de forma m\u00e1s eficiente en medicina de precisi\u00f3n y dise\u00f1ar nuevos f\u00e1rmacos m\u00e1s seguros y eficaces para el tratamiento del c\u00e1ncer. El grupo tambi\u00e9n colabora activamente en iniciativas internacionales de ciencia abierta en qu\u00edmica biol\u00f3gica centradas en la recopilaci\u00f3n, estandarizaci\u00f3n y accesibilidad de Big Data. Por \u00faltimo, tambi\u00e9n desarrolla sus propias herramientas de inteligencia artificial para acelerar el descubrimiento de f\u00e1rmacos.<\/p>\n<h3> 33<\/h3>\n<h2>Publicaciones<\/h2>\n\t\t\t\t<img loading=\"lazy\" decoding=\"async\" src=\"https:\/\/idibell.cat\/es\/wp-content\/uploads\/sites\/4\/2024\/11\/Medicinal-chemistry-drug-design.jpg\" alt=\"Medicinal-chemistry-&amp;-drug-design\" itemprop=\"image\" height=\"300\" width=\"600\" title=\"Medicinal-chemistry-&amp;-drug-design\" onerror=\"this.style.display='none'\"  \/>\n\t\t\t\t\t<a href=\"#\" id=\"fl-accordion--label-0\" tabindex=\"0\" aria-controls=\"fl-accordion--panel-0\">L\u00edneas estrat\u00e9gicas<\/a>\n\t\t\t\t\t\t\t\t\t\t\t<a href=\"#\" id=\"fl-accordion--icon-0\" tabindex=\"-1\"><i title=\"Expand\">Expand<\/i><\/a>\n\t\t\t\t\t<ul>\n<li>Desarrollar recursos de biolog\u00eda qu\u00edmica de ciencia abierta.<\/li>\n<li>Aprovechar los efectos de los medicamentos a nivel de sistemas en medicina de precisi\u00f3n.<\/li>\n<li>Explotar Big Data e IA para descubrir medicamentos m\u00e1s eficaces<\/li>\n<\/ul>\n\t\t\t\t\t<a href=\"#\" id=\"fl-accordion--label-1\" tabindex=\"0\" aria-controls=\"fl-accordion--panel-1\">Publicaciones seleccionadas<\/a>\n\t\t\t\t\t\t\t\t\t\t\t<a href=\"#\" id=\"fl-accordion--icon-1\" tabindex=\"-1\"><i title=\"Expand\">Expand<\/i><\/a>\n\t\t\t\t\t<ul>\n<li>Manen-Freixa L, *Antolin AA. <strong>Polypharmacology prediction: the long road toward comprehensively anticipating small-molecule selectivity to de-risk drug discovery. Expert Opin Drug Discov<\/strong>. 19, 1043-1069 (2024).<\/li>\n<li>Hu H, Serra C, Zhang W, Scrivo A, Fernandez-Carasa I, Consiglio A, Aytes A, Pujana MA, *Llebaria A, *Antolin AA. <strong>Identification of differential biological activity and synergy between the PARP inhibitor rucaparib and its major metabolite<\/strong>. Cell Chemical Biology, 31, 973-988 (2024).<\/li>\n<li>di Micco,+ Antolin AA,+ Mitsopoulos C, Villasclaras Fernandez E, Mica IL, et al. <strong>canSAR: update to the cancer translational research and drug discovery knowledgebase<\/strong>. Nucleic Acids Res. 51, D1212-D1219 (2023).<\/li>\n<li>Antolin AA, Sanfelice D, Crisp A, Villasclaras Fernandez E, Mica IL, et al. <strong>The Chemical Probes Portal: an expert review based public resource to empower chemical probe assessment, selection and use<\/strong>. Nucleic Acids Res. 51, D1492-D1502 (2023).<\/li>\n<li>Hu H, Tjaden A, Knapp S, *Antolin AA, *M\u00fcller S. <strong>A machine learning and live-cell imaging tool kit uncovers small molecules induced phospholipidosis<\/strong>. Cell Chem Biol. 30, 1634-1651(2023).<\/li>\n<\/ul>\n\t\t\t\t\t<a href=\"#\" id=\"fl-accordion--label-2\" tabindex=\"0\" aria-controls=\"fl-accordion--panel-2\">Proyectos seleccionados<\/a>\n\t\t\t\t\t\t\t\t\t\t\t<a href=\"#\" id=\"fl-accordion--icon-2\" tabindex=\"-1\"><i title=\"Expand\">Expand<\/i><\/a>\n\t\t\t\t\t<ul>\n<li><strong>Systems-based Characterization of Drug Metabolites to Exploit them in Precision medicine<\/strong>. Agency: Spanish Ministry of Economy (MINECO) &#8211; Plan Nacional. IP: Dr. Albert Antolin. 2023-2026. Amount: 130.000 \u20ac.<\/li>\n<li><strong>Systems Drug Discovery to Tackle Cancer Drug Resistance<\/strong>. Agency: Instituto de Salud Carlos III (ISCIII) &#8211; Miguel Servet Fellowship. IP: Dr. Albert Antolin. 2023 &#8211; 2028. Amount: 240.000 \u20ac.<\/li>\n<li><strong>Rational development of KRAS inhibitors that simultaneously inhibit kinases<\/strong>. Agency: VIVAN Therapeutics (London, UK) &#8211; industrial collaboration. IP: Dr. Albert Antolin (coordinator), Prof. Paul Workman (ICR) and Dr. Nahuel Villegas (VIVAN). 2023 &#8211; June 2024. Amount: 50.000 \u00a3<\/li>\n<li><strong>Systems Drug Discovery to Tackle Cancer Drug Resistance<\/strong>. Agency: La Caixa Foundation. IP: Dr. Albert Antolin. 2022 &#8211; 2023. Amount: 300.000 \u20ac.<\/li>\n<\/ul>\n\t\t\t\t<img loading=\"lazy\" decoding=\"async\" src=\"https:\/\/idibell.cat\/es\/wp-content\/uploads\/sites\/4\/2023\/01\/Albert-Antolin-Hernandez-150x150.jpg\" alt=\"Albert-Antolin-Hernandez\" itemprop=\"image\" height=\"150\" width=\"150\" title=\"Albert-Antolin-Hernandez\" onerror=\"this.style.display='none'\"  \/>\n<h4>\n\t\tAntolin Hernandez, Albert\n\t<\/h4>\n<h4>\n\t\t<a href=\"mailto:aantolin@idibell.cat\" title=\"aantolin@idibell.cat\" target=\"_blank\" rel=\"noopener\">\n\t\taantolin@idibell.cat\n\t\t<\/a>\n\t<\/h4>\n<h2>\n\t\tInvestigadores principales\n\t<\/h2>\n\t\t\t\t<img loading=\"lazy\" decoding=\"async\" src=\"https:\/\/idibell.cat\/es\/wp-content\/uploads\/sites\/4\/2023\/01\/Albert-Antolin-Hernandez-150x150.jpg\" alt=\"Albert-Antolin-Hernandez\" itemprop=\"image\" height=\"150\" width=\"150\" title=\"Albert-Antolin-Hernandez\" onerror=\"this.style.display='none'\"  \/>\n<h4>\n\t\tAntolin Hernandez, Albert\n\t<\/h4>\n<h4>\n\t\t<a href=\"mailto:aantolin@idibell.cat\" title=\"aantolin@idibell.cat\" target=\"_blank\" rel=\"noopener\">\n\t\taantolin@idibell.cat\n\t\t<\/a>\n\t<\/h4>\n<h4>\n\t\tENLACES RELACIONADOS\n\t<\/h4>\n<h4>\n\t\t<a href=\"https:\/\/procure-oncology.com\/portfolio-item\/antolins-lab\/\" title=\"ProCURE\" target=\"_blank\" rel=\"noopener\">\n\t\tProCURE\n\t\t<\/a>\n\t<\/h4>\n<h4>\n\t\t<a href=\"https:\/\/twitter.com\/ProcureICO\" title=\"@ProcureICO\" target=\"_blank\" rel=\"noopener\">\n\t\t@ProcureICO\n\t\t<\/a>\n\t<\/h4>\n<h4>\n\t\t<a href=\"https:\/\/twitter.com\/antolin_aa\" title=\"@antolin_aa\" target=\"_blank\" rel=\"noopener\">\n\t\t@antolin_aa\n\t\t<\/a>\n\t<\/h4>\n<h4>\n\t\t<a href=\"https:\/\/www.chemicalprobes.org\/people\" title=\"Chemical Probes Portal\" target=\"_blank\" rel=\"noopener\">\n\t\tChemical Probes Portal\n\t\t<\/a>\n\t<\/h4>\n<h4>\n\t\t<a href=\"https:\/\/aircheck.ai\/mainframe\" title=\"MAINFRAME\" target=\"_blank\" rel=\"noopener\">\n\t\tMAINFRAME\n\t\t<\/a>\n\t<\/h4>\n<h2>\n\t\tEquipo\n\t<\/h2>\n\t\t\t\t\t\t\t\t<a href=\"#\" id=\"fl-tabs--label-0\" data-index=\"0\" aria-selected=\"true\" aria-controls=\"fl-tabs--panel-0\" aria-expanded=\"true\" role=\"tab\" tabindex=\"0\">\t\t\t\tJefes\/as de grupo\t\t\t\t<\/a>\n\t\t\t\t\t\t\t\t<a href=\"#\" id=\"fl-tabs--label-1\" data-index=\"1\" aria-selected=\"false\" aria-controls=\"fl-tabs--panel-1\" aria-expanded=\"false\" role=\"tab\" tabindex=\"0\">\t\t\t\tInvestigadores\/as postdoctorales\t\t\t\t<\/a>\n\t\t\t\t\t\t\t\t<a href=\"#\" id=\"fl-tabs--label-2\" data-index=\"2\" aria-selected=\"false\" aria-controls=\"fl-tabs--panel-2\" aria-expanded=\"false\" role=\"tab\" tabindex=\"0\">\t\t\t\tInvestigadores\/as predoctorales\t\t\t\t<\/a>\n\t\t\t\t\t\t\t\t<a href=\"#\" id=\"fl-tabs--label-3\" data-index=\"3\" aria-selected=\"false\" aria-controls=\"fl-tabs--panel-3\" aria-expanded=\"false\" role=\"tab\" tabindex=\"0\">\t\t\t\tSoporte cient\u00edfico\t\t\t\t<\/a>\n\t\t\t\t\t\tJefes\/as de grupo\n\t\t\t\t\t\t\t\t\t\t\t<ul>\n<li>Antolin Hernandez, Albert<\/li>\n<\/ul>\n\t\t\t\t\t\tInvestigadores\/as postdoctorales\n\t\t\t\t\t\t\t\t\t\t\t<ul>\n<li>Manen Freixa, Leticia<\/li>\n<\/ul>\n\t\t\t\t\t\tInvestigadores\/as predoctorales\n\t\t\t\t\t\t\t\t\t\t\t<ul>\n<li>Ruvo, Luca<\/li>\n<\/ul>\n\t\t\t\t\t\tSoporte cient\u00edfico\n\t\t\t\t\t\t\t\t\t\t\t<ul>\n<li>Santos Gil, Santiago<\/li>\n<\/ul>\n<h2>\n\t\tNoticias relacionadas\n\t<\/h2>\n\t<meta itemscope itemprop=\"mainEntityOfPage\" itemtype=\"https:\/\/schema.org\/WebPage\" itemid=\"http:\/\/24187\" content=\"La reutilizaci\u00f3n de medicamentos: nuevas oportunidades para los pacientes oncol\u00f3gicos\" \/><meta itemprop=\"datePublished\" content=\"2024-04-19\" \/><meta itemprop=\"dateModified\" content=\"2024-11-21\" \/><meta itemprop=\"name\" content=\"IDIBELL\"\/><meta itemprop=\"url\" 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y ciencia de datos para entender mejor el mecanismo de acci\u00f3n de los f\u00e1rmacos para utilizarlos de forma m\u00e1s eficiente en medicina de precisi\u00f3n [&hellip;]<\/p>\n","protected":false},"author":8,"featured_media":0,"parent":448,"menu_order":0,"comment_status":"closed","ping_status":"closed","template":"","meta":{"site-sidebar-layout":"no-sidebar","site-content-layout":"page-builder","ast-site-content-layout":"full-width-container","site-content-style":"unboxed","site-sidebar-style":"unboxed","ast-global-header-display":"","ast-banner-title-visibility":"","ast-main-header-display":"","ast-hfb-above-header-display":"","ast-hfb-below-header-display":"","ast-hfb-mobile-header-display":"","site-post-title":"disabled","ast-breadcrumbs-content":"","ast-featured-img":"disabled","footer-sml-layout":"","theme-transparent-header-meta":"default","adv-header-id-meta":"","stick-header-meta":"default","header-above-stick-meta":"","header-main-stick-meta":"","header-below-stick-meta":"","astra-migrate-meta-layouts":"set","ast-page-background-enabled":"default","ast-page-background-meta":{"desktop":{"background-color":"","background-image":"","background-repeat":"repeat","background-position":"center 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