Heterocycle-Based Multicomponent Reactions in Drug Discovery: From Hit Finding to Rational Design
Pau Nadal Rodríguez,
Ouldouz Ghashghaei,
Andrea Bagán,
Carmen Escolano,
Rodolfo Lavilla
Affiliations
Pau Nadal Rodríguez
Laboratory of Medicinal Chemistry, Faculty of Pharmacy and Food Sciences, University of Barcelona and Institute of Biomedicine (IBUB), Avda Joan XXIII 27–30, 08028 Barcelona, Spain
Ouldouz Ghashghaei
Laboratory of Medicinal Chemistry, Faculty of Pharmacy and Food Sciences, University of Barcelona and Institute of Biomedicine (IBUB), Avda Joan XXIII 27–30, 08028 Barcelona, Spain
Andrea Bagán
Laboratory of Medicinal Chemistry, Faculty of Pharmacy and Food Sciences, University of Barcelona and Institute of Biomedicine (IBUB), Avda Joan XXIII 27–30, 08028 Barcelona, Spain
Carmen Escolano
Laboratory of Medicinal Chemistry, Faculty of Pharmacy and Food Sciences, University of Barcelona and Institute of Biomedicine (IBUB), Avda Joan XXIII 27–30, 08028 Barcelona, Spain
Rodolfo Lavilla
Laboratory of Medicinal Chemistry, Faculty of Pharmacy and Food Sciences, University of Barcelona and Institute of Biomedicine (IBUB), Avda Joan XXIII 27–30, 08028 Barcelona, Spain
In the context of the structural complexity necessary for a molecule to selectively display a therapeutical action and the requirements for suitable pharmacokinetics, a robust synthetic approach is essential. Typically, thousands of relatively similar compounds should be prepared along the drug discovery process. In this respect, heterocycle-based multicomponent reactions offer advantages over traditional stepwise sequences in terms of synthetic economy, as well as the fast access to chemsets to study the structure activity relationships, the fine tuning of properties, and the preparation of larger amounts for preclinical phases. In this account, we briefly summarize the scientific methodology backing the research line followed by the group. We comment on the main results, clustered according to the targets and, finally, in the conclusion section, we offer a general appraisal of the situation and some perspectives regarding future directions in academic and private research.
