Inside Perspective of the Synthetic and Computational Toolbox of JAK Inhibitors: Recent Updates

by Adriana Coricello, Francesco Mesiti, Antonio Lupia, Annalisa Maruca, Stefano Alcaro
Published 2020-07-01

In Silico Food-Drug Interaction: A Case Study of Eluxadoline and Fatty Meal

by Annalisa Maruca, Antonio Lupia, Roberta Rocca, Daniel Keszthelyi, Maura Corsetti, Stefano Alcaro
Published 2020-11-01

Chemoinformatic Database Building and in Silico Hit-Identification of Potential Multi-Targeting Bioactive Compounds Extracted from Mushroom Species

by Annalisa Maruca, Federica Moraca, Roberta Rocca, Fulvia Molisani, Francesca Alcaro, Maria Concetta Gidaro, Stefano Alcaro, Giosuè Costa, Francesco Ortuso
Published 2017-09-01

Natural Products Extracted from Fungal Species as New Potential Anti-Cancer Drugs: A Structure-Based Drug Repurposing Approach Targeting HDAC7

by Annalisa Maruca, Roberta Rocca, Raffaella Catalano, Francesco Mesiti, Giosuè Costa, Delia Lanzillotta, Alessandro Salatino, Francesco Ortuso, Francesco Trapasso, Stefano Alcaro, Anna Artese
Published 2020-11-01

The Mu.Ta.Lig. Chemotheca: A Community-Populated Molecular Database for Multi-Target Ligands Identification and Compound-Repurposing

by Francesco Ortuso, Donatella Bagetta, Annalisa Maruca, Carmine Talarico, Maria L. Bolognesi, Norbert Haider, Fernanda Borges, Sharon Bryant, Thierry Langer, Hanoch Senderowitz, Stefano Alcaro
Published 2018-04-01

Multi-Targeting Bioactive Compounds Extracted from Essential Oils as Kinase Inhibitors

by Annalisa Maruca, Delia Lanzillotta, Roberta Rocca, Antonio Lupia, Giosuè Costa, Raffaella Catalano, Federica Moraca, Eugenio Gaudio, Francesco Ortuso, Anna Artese, Francesco Trapasso, Stefano Alcaro
Published 2020-05-01

In Silico Identification and Biological Evaluation of Antioxidant Food Components Endowed with IX and XII <i>h</i>CA Inhibition

by Giosuè Costa, Annalisa Maruca, Roberta Rocca, Francesca Alessandra Ambrosio, Emanuela Berrino, Fabrizio Carta, Francesco Mesiti, Alessandro Salatino, Delia Lanzillotta, Francesco Trapasso, Anna Artese, Stefano Alcaro, Claudiu T. Supuran
Published 2020-08-01

Probing Substituents in the 1- and 3-Position: Tetrahydropyrazino-Annelated Water-Soluble Xanthine Derivatives as Multi-Target Drugs With Potent Adenosine Receptor Antagonistic Act...

by Pierre Koch, Andreas Brunschweiger, Vigneshwaran Namasivayam, Stefan Ullrich, Annalisa Maruca, Beatrice Lazzaretto, Petra Küppers, Sonja Hinz, Jörg Hockemeyer, Michael Wiese, Jag Heer, Stefano Alcaro, Katarzyna Kiec-Kononowicz, Christa E. Müller
Published 2018-06-01