Extensive Molecular Dynamics Simulations Disclosed the Stability of mPGES‐1 Enzyme and the Structural Role of Glutathione (GSH) Cofactor

por Di Micco, Simone, Lauro, Gianluigi, Bifulco, Giuseppe
Publicado 2022

Insights into the Ligand Binding to Bromodomain-Containing Protein 9 (BRD9): A Guide to the Selection of Potential Binders by Computational Methods

por De Vita, Simona, Chini, Maria Giovanna, Bifulco, Giuseppe, Lauro, Gianluigi
Publicado 2021

Corylus avellana: A Source of Diarylheptanoids With α-Glucosidase Inhibitory Activity Evaluated by in vitro and in silico Studies

por Masullo, Milena, Lauro, Gianluigi, Cerulli, Antonietta, Bifulco, Giuseppe, Piacente, Sonia
Publicado 2022

Accelerating the repurposing of FDA-approved drugs against coronavirus disease-19 (COVID-19)

por De Vita, Simona, Chini, Maria Giovanna, Lauro, Gianluigi, Bifulco, Giuseppe
Publicado 2020

DFT/NMR Approach for the Configuration Assignment of Groups of Stereoisomers by the Combination and Comparison of Experimental and Predicted Sets of Data

por Lauro, Gianluigi, Das, Pronay, Riccio, Raffaele, Reddy, D. Srinivasa, Bifulco, Giuseppe
Publicado 2020

Structural Refinement of 2,4-Thiazolidinedione Derivatives as New Anticancer Agents Able to Modulate the BAG3 Protein

por Ruggiero, Dafne, Terracciano, Stefania, Lauro, Gianluigi, Pecoraro, Michela, Franceschelli, Silvia, Bifulco, Giuseppe, Bruno, Ines
Publicado 2022

Predictor factors for non-invasive mechanical ventilation failure in severe COVID-19 patients in the intensive care unit: a single-center retrospective study

por Romanelli, Antonio, Toigo, Pietro, Scarpati, Giuliana, Caccavale, Angela, Lauro, Gianluigi, Baldassarre, Daniela, Oliva, Filomena, Lacava, Graziella, Pascale, Gabriele, Piazza, Ornella
Publicado 2022

9H-Purine Scaffold Reveals Induced-Fit Pocket Plasticity of the BRD9 Bromodomain

por Picaud, Sarah, Strocchia, Maria, Terracciano, Stefania, Lauro, Gianluigi, Mendez, Jacqui, Daniels, Danette L., Riccio, Raffaele, Bifulco, Giuseppe, Bruno, Ines, Filippakopoulos, Panagis
Publicado 2015

Oxygenated Polyketides from Plakinastrella mamillaris as a New Chemotype of PXR Agonists

por Festa, Carmen, D’Amore, Claudio, Renga, Barbara, Lauro, Gianluigi, De Marino, Simona, D’Auria, Maria Valeria, Bifulco, Giuseppe, Zampella, Angela, Fiorucci, Stefano
Publicado 2013

Chemistry and Selective Tumor Cell Growth Inhibitory Activity of Polyketides from the South China Sea Sponge Plakortis sp.

por Li, Jiao, Li, Cui, Riccio, Raffaele, Lauro, Gianluigi, Bifulco, Giuseppe, Li, Tie-Jun, Tang, Hua, Zhuang, Chun-Lin, Ma, Hao, Sun, Peng, Zhang, Wen
Publicado 2017

Discovery of a Secalonic Acid Derivative from Aspergillus aculeatus, an Endophyte of Rosa damascena Mill., Triggers Apoptosis in MDA-MB-231 Triple Negative Breast Cancer Cells

por Farooq, Sadaqat, Qayum, Arem, Nalli, Yedukondalu, Lauro, Gianluigi, Chini, Maria Giovanna, Bifulco, Giuseppe, Chaubey, Asha, Singh, Shashank K., Riyaz-Ul-Hassan, Syed, Ali, Asif
Publicado 2020

Repositioning of Quinazolinedione-Based Compounds on Soluble Epoxide Hydrolase (sEH) through 3D Structure-Based Pharmacophore Model-Driven Investigation

por Gazzillo, Erica, Terracciano, Stefania, Ruggiero, Dafne, Potenza, Marianna, Chini, Maria Giovanna, Lauro, Gianluigi, Fischer, Katrin, Hofstetter, Robert Klaus, Giordano, Assunta, Werz, Oliver, Bruno, Ines, Bifulco, Giuseppe
Publicado 2022

Inhibition of Wnt/β-Catenin pathway and Histone acetyltransferase activity by Rimonabant: a therapeutic target for colon cancer

por Proto, Maria Chiara, Fiore, Donatella, Piscopo, Chiara, Franceschelli, Silvia, Bizzarro, Valentina, Laezza, Chiara, Lauro, Gianluigi, Feoli, Alessandra, Tosco, Alessandra, Bifulco, Giuseppe, Sbardella, Gianluca, Bifulco, Maurizio, Gazzerro, Patrizia
Publicado 2017

Phytochemical Analysis of the Methanolic Extract and Essential Oil from Leaves of Industrial Hemp Futura 75 Cultivar: Isolation of a New Cannabinoid Derivative and Biological Profi...

por De Vita, Simona, Finamore, Claudia, Chini, Maria Giovanna, Saviano, Gabriella, De Felice, Vincenzo, De Marino, Simona, Lauro, Gianluigi, Casapullo, Agostino, Fantasma, Francesca, Trombetta, Federico, Bifulco, Giuseppe, Iorizzi, Maria
Publicado 2022

Biological Profile of Two Gentiana lutea L. Metabolites Using Computational Approaches and In Vitro Tests

por De Vita, Simona, Chini, Maria Giovanna, Saviano, Gabriella, Finamore, Claudia, Festa, Carmen, Lauro, Gianluigi, De Marino, Simona, Russo, Roberto, Avagliano, Carmen, Casapullo, Agostino, Calignano, Antonio, Bifulco, Giuseppe, Iorizzi, Maria
Publicado 2021

In Silico, In Vitro and In Vivo Analysis of Tanshinone IIA and Cryptotanshinone from Salvia miltiorrhiza as Modulators of Cyclooxygenase-2/mPGES-1/Endothelial Prostaglandin EP3 Pat...

por Saviano, Anella, De Vita, Simona, Chini, Maria Giovanna, Marigliano, Noemi, Lauro, Gianluigi, Casillo, Gian Marco, Raucci, Federica, Iorizzi, Maria, Hofstetter, Robert Klaus, Fischer, Katrin, Koeberle, Andreas, Werz, Oliver, Maione, Francesco, Bifulco, Giuseppe
Publicado 2022

Identification of 2-Aminoacyl-1,3,4-thiadiazoles as Prostaglandin E(2) and Leukotriene Biosynthesis Inhibitors

por Potenza, Marianna, Giordano, Assunta, Chini, Maria G., Saviano, Anella, Kretzer, Christian, Raucci, Federica, Russo, Marina, Lauro, Gianluigi, Terracciano, Stefania, Bruno, Ines, Iorizzi, Maria, Hofstetter, Robert K., Pace, Simona, Maione, Francesco, Werz, Oliver, Bifulco, Giuseppe
Publicado 2022

Neurally adjusted ventilatory assist preserves cerebral blood flow velocity in patients recovering from acute brain injury

por Cammarota, Gianmaria, Verdina, Federico, Lauro, Gianluigi, Boniolo, Ester, Tarquini, Riccardo, Messina, Antonio, De Vita, Nello, Sguazzoti, Ilaria, Perucca, Raffaella, Corte, Francesco Della, Vignazia, Gian Luca, Grossi, Francesca, Crudo, Samuele, Navalesi, Paolo, Santangelo, Erminio, Vaschetto, Rosanna
Publicado 2020

Exploration of TRPM8 Binding Sites by β-Carboline-Based Antagonists and Their In Vitro Characterization and In Vivo Analgesic Activities

por Bertamino, Alessia, Ostacolo, Carmine, Medina, Alicia, Di Sarno, Veronica, Lauro, Gianluigi, Ciaglia, Tania, Vestuto, Vincenzo, Pepe, Giacomo, Basilicata, Manuela Giovanna, Musella, Simona, Smaldone, Gerardina, Cristiano, Claudia, Gonzalez-Rodriguez, Sara, Fernandez-Carvajal, Asia, Bifulco, Giuseppe, Campiglia, Pietro, Gomez-Monterrey, Isabel, Russo, Roberto
Publicado 2020

Identification of a dual acting SARS-CoV-2 proteases inhibitor through in silico design and step-by-step biological characterization

por Di Sarno, Veronica, Lauro, Gianluigi, Musella, Simona, Ciaglia, Tania, Vestuto, Vincenzo, Sala, Marina, Scala, Maria Carmina, Smaldone, Gerardina, Di Matteo, Francesca, Novi, Sara, Tecce, Mario Felice, Moltedo, Ornella, Bifulco, Giuseppe, Campiglia, Pietro, Gomez-Monterrey, Isabel M., Snoeck, Robert, Andrei, Graciela, Ostacolo, Carmine, Bertamino, Alessia
Publicado 2021