Andrea Brancale

Scopus Author ID ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 49

Top Topics

Molecular Docking

Trypanosoma Cruzi

Epidermal Growth Factor Receptor

Top Venues

Journal of medicinal chemistry

Journal of chemical information and modeling

Nature communications

This page only lists publications with an associated author ORCID identifier.

Publications

Gregory Mathez, Andrea Brancale, Valeria Cagno
Novel Inhibitors of SARS-CoV-2 RNA Identified through Virtual Screening. Journal of chemical information and modeling 64 (15) (2024)
Gregory Mathez, Andrea Brancale, Valeria Cagno
Novel Inhibitors of SARS-CoV-2 RNA Identified through Virtual Screening. Journal of chemical information and modeling (2024)
James R Tribble, Melissa Jöe, Carmine Varricchio, Amin Otmani, Alessio Canovai, Baninia Habchi, Evangelia Daskalakis, Romanas Chaleckis, Andrea Loreto, Jonathan Gilley, Craig E Wheelock, Gauti Jóhannesson, Raymond Ching-Bong Wong, Michael P Coleman, Andrea Brancale, Pete A Williams
NMNAT2 is a druggable target to drive neuronal NAD production. Nature communications 15 (1) (2024)
James R Tribble, Melissa Jöe, Carmine Varricchio, Amin Otmani, Alessio Canovai, Baninia Habchi, Evangelia Daskalakis, Romanas Chaleckis, Andrea Loreto, Jonathan Gilley, Craig E Wheelock, Gauti Jóhannesson, Raymond Ching-Bong Wong, Michael P Coleman, Andrea Brancale, Pete A Williams
Author Correction: NMNAT2 is a druggable target to drive neuronal NAD production. Nature communications 15 (1) (2024)
Gregory Mathez, Andrea Brancale, Valeria Cagno
Novel Inhibitors of SARS-CoV-2 RNA Identified through Virtual Screening. Journal of chemical information and modeling 64 (15) (2024)
James R Tribble, Melissa Jöe, Carmine Varricchio, Amin Otmani, Alessio Canovai, Baninia Habchi, Evangelia Daskalakis, Romanas Chaleckis, Andrea Loreto, Jonathan Gilley, Craig E Wheelock, Gauti Jóhannesson, Raymond Ching-Bong Wong, Michael P Coleman, Andrea Brancale, Pete A Williams
NMNAT2 is a druggable target to drive neuronal NAD production. Nature communications 15 (1) (2024)
James R Tribble, Melissa Jöe, Carmine Varricchio, Amin Otmani, Alessio Canovai, Baninia Habchi, Evangelia Daskalakis, Romanas Chaleckis, Andrea Loreto, Jonathan Gilley, Craig E Wheelock, Gauti Jóhannesson, Raymond Ching-Bong Wong, Michael P Coleman, Andrea Brancale, Pete A Williams
NMNAT2 is a druggable target to drive neuronal NAD production. Nature communications 15 (1) (2024)
Gregory Mathez, Andrea Brancale, Valeria Cagno
Novel Inhibitors of SARS-CoV-2 RNA Identified through Virtual Screening. Journal of chemical information and modeling 64 (15) (2024)
Karol R Francisco, Jessica Bruystens, Carmine Varricchio, Sara McCurdy, Jian Wu, Miguel A Lopez-Ramirez, Mark Ginsberg, Conor R Caffrey, Andrea Brancale, Alexandre R Gingras, Mark S Hixon, Carlo Ballatore
Targeted Reversible Covalent Modification of a Noncatalytic Lysine of the Krev Interaction Trapped 1 Protein Enables Site-Directed Screening for Protein-Protein Interaction Inhibitors. ACS pharmacology & translational science 6 (11) (2023)
Gilda Padalino, Cassandra A Celatka, Hugh Y Rienhoff, Jay H Kalin, Philip A Cole, Damien Lassalle, Josephine Forde-Thomas, Iain W Chalmers, Andrea Brancale, Christoph Grunau, Karl F Hoffmann
Chemical modulation of Schistosoma mansoni lysine specific demethylase 1 (SmLSD1) induces wide-scale biological and epigenomic changes. Wellcome open research 8 (2023)
Luis Queiros-Reis, João Rodrigo Mesquita, Andrea Brancale, Marcella Bassetto
Exploring the Fatty Acid Binding Pocket in the SARS-CoV-2 Spike Protein - Confirmed and Potential Ligands. Journal of chemical information and modeling (2023)
Karolína Salvadori, Alessia Onali, Gregory Mathez, Václav Eigner, Marcela Dendisová, Pavel Matějka, Monika Mullerová, Andrea Brancale, Petra Cuřínová
An Insight into Anion Extraction by Amphiphiles: Hydrophobic Microenvironments as a Requirement for the Extractant Selectivity. ACS omega 8 (46) (2023)
Haoyue Xiang, Salvatore Ferla, Carmine Varricchio, Andrea Brancale, Nicola L Brown, Gary W Black, Nicholas J Turner, Daniele Castagnolo
Biocatalytic and Chemo-Enzymatic Synthesis of Quinolines and 2-Quinolones by Monoamine Oxidase (MAO-N) and Horseradish Peroxidase (HRP) Biocatalysts. ACS catalysis 13 (5) (2023)
Haoyue Xiang, Salvatore Ferla, Carmine Varricchio, Andrea Brancale, Nicola L Brown, Gary W Black, Nicholas J Turner, Daniele Castagnolo
Biocatalytic and Chemo-Enzymatic Synthesis of Quinolines and 2-Quinolones by Monoamine Oxidase (MAO-N) and Horseradish Peroxidase (HRP) Biocatalysts. ACS catalysis 13 (5) (2023)
Gilda Giancotti, Giulio Nannetti, Gilda Padalino, Martina Landini, Nanci Santos-Ferreira, Jana Van Dycke, Valentina Naccarato, Usheer Patel, Romano Silvestri, Johan Neyts, Roberto Gozalbo-Rovira, Jésus Rodríguez-Díaz, Joana Rocha-Pereira, Andrea Brancale, Salvatore Ferla, Marcella Bassetto
Structural Investigations on Novel Non-Nucleoside Inhibitors of Human Norovirus Polymerase. Viruses 15 (1) (2022)
Gilda Giancotti, Giulio Nannetti, Gilda Padalino, Martina Landini, Nanci Santos-Ferreira, Jana Van Dycke, Valentina Naccarato, Usheer Patel, Romano Silvestri, Johan Neyts, Roberto Gozalbo-Rovira, Jésus Rodríguez-Díaz, Joana Rocha-Pereira, Andrea Brancale, Salvatore Ferla, Marcella Bassetto
Structural Investigations on Novel Non-Nucleoside Inhibitors of Human Norovirus Polymerase. Viruses 15 (1) (2022)
Gilda Giancotti, Giulio Nannetti, Gilda Padalino, Martina Landini, Nanci Santos-Ferreira, Jana Van Dycke, Valentina Naccarato, Usheer Patel, Romano Silvestri, Johan Neyts, Roberto Gozalbo-Rovira, Jésus Rodríguez-Díaz, Joana Rocha-Pereira, Andrea Brancale, Salvatore Ferla, Marcella Bassetto
Structural Investigations on Novel Non-Nucleoside Inhibitors of Human Norovirus Polymerase. Viruses 15 (1) (2022)
Thibault Alle, Carmine Varricchio, Yuemang Yao, Bobby Lucero, Goodwell Nzou, Stefania Demuro, Megan Muench, Khoa D Vuong, Killian Oukoloff, Anne-Sophie Cornec, Karol R Francisco, Conor R Caffrey, Virginia M-Y Lee, Amos B Smith Iii, Andrea Brancale, Kurt R Brunden, Carlo Ballatore
Microtubule-Stabilizing 1,2,4-Triazolo[1,5- a ]pyrimidines as Candidate Therapeutics for Neurodegenerative Disease: Matched Molecular Pair Analyses and Computational Studies Reveal New Structure-Activity Insights. Journal of medicinal chemistry (2022)
Thibault Alle, Carmine Varricchio, Yuemang Yao, Bobby Lucero, Goodwell Nzou, Stefania Demuro, Megan Muench, Khoa D Vuong, Killian Oukoloff, Anne-Sophie Cornec, Karol R Francisco, Conor R Caffrey, Virginia M-Y Lee, Amos B Smith Iii, Andrea Brancale, Kurt R Brunden, Carlo Ballatore
Microtubule-Stabilizing 1,2,4-Triazolo[1,5- a ]pyrimidines as Candidate Therapeutics for Neurodegenerative Disease: Matched Molecular Pair Analyses and Computational Studies Reveal New Structure-Activity Insights. Journal of medicinal chemistry 66 (1) (2022)
Thibault Alle, Carmine Varricchio, Yuemang Yao, Bobby Lucero, Goodwell Nzou, Stefania Demuro, Megan Muench, Khoa D Vuong, Killian Oukoloff, Anne-Sophie Cornec, Karol R Francisco, Conor R Caffrey, Virginia M-Y Lee, Amos B Smith Iii, Andrea Brancale, Kurt R Brunden, Carlo Ballatore
Microtubule-Stabilizing 1,2,4-Triazolo[1,5- a ]pyrimidines as Candidate Therapeutics for Neurodegenerative Disease: Matched Molecular Pair Analyses and Computational Studies Reveal New Structure-Activity Insights. Journal of medicinal chemistry 66 (1) (2022)
Anoop Narayanan, Manju Narwal, Sydney A Majowicz, Carmine Varricchio, Shay A Toner, Carlo Ballatore, Andrea Brancale, Katsuhiko S Murakami, Joyce Jose
Identification of SARS-CoV-2 inhibitors targeting Mpro and PLpro using in-cell-protease assay. Communications biology 5 (1) (2022)
Thibault Alle, Carmine Varricchio, Yuemang Yao, Bobby Lucero, Goodwell Nzou, Stefania Demuro, Megan Muench, Khoa D Vuong, Killian Oukoloff, Anne-Sophie Cornec, Karol R Francisco, Conor R Caffrey, Virginia M-Y Lee, Amos B Smith Iii, Andrea Brancale, Kurt R Brunden, Carlo Ballatore
Microtubule-Stabilizing 1,2,4-Triazolo[1,5- a ]pyrimidines as Candidate Therapeutics for Neurodegenerative Disease: Matched Molecular Pair Analyses and Computational Studies Reveal New Structure-Activity Insights. Journal of medicinal chemistry 66 (1) (2022)
Romeo Romagnoli, Paola Oliva, Filippo Prencipe, Stefano Manfredini, Federica Budassi, Andrea Brancale, Salvatore Ferla, Ernest Hamel, Diana Corallo, Sanja Aveic, Lorenzo Manfreda, Elena Mariotto, Roberta Bortolozzi, Giampietro Viola
Design, Synthesis and Biological Investigation of 2-Anilino Triazolopyrimidines as Tubulin Polymerization Inhibitors with Anticancer Activities. Pharmaceuticals (Basel, Switzerland) 15 (8) (2022)
Paola Oliva, Romeo Romagnoli, Barbara Cacciari, Stefano Manfredini, Chiara Padroni, Andrea Brancale, Salvatore Ferla, Ernest Hamel, Diana Corallo, Sanja Aveic, Noemi Milan, Elena Mariotto, Giampietro Viola, Roberta Bortolozzi
Synthesis and Biological Evaluation of Highly Active 7-Anilino Triazolopyrimidines as Potent Antimicrotubule Agents. Pharmaceutics 14 (6) (2022)
Thibault Alle, Carmine Varricchio, Yuemang Yao, Bobby Lucero, Goodwell Nzou, Stefania Demuro, Megan Muench, Khoa D Vuong, Killian Oukoloff, Anne-Sophie Cornec, Karol R Francisco, Conor R Caffrey, Virginia M-Y Lee, Amos B Smith Iii, Andrea Brancale, Kurt R Brunden, Carlo Ballatore
Microtubule-Stabilizing 1,2,4-Triazolo[1,5- a ]pyrimidines as Candidate Therapeutics for Neurodegenerative Disease: Matched Molecular Pair Analyses and Computational Studies Reveal New Structure-Activity Insights. Journal of medicinal chemistry 66 (1) (2022)
Daniel L Hurdiss, Priscila El Kazzi, Lisa Bauer, Nicolas Papageorgiou, François P Ferron, Tim Donselaar, Arno L W van Vliet, Tatiana M Shamorkina, Joost Snijder, Bruno Canard, Etienne Decroly, Andrea Brancale, Tzviya Zeev-Ben-Mordehai, Friedrich G Förster, Frank J M van Kuppeveld, Bruno Coutard
Fluoxetine targets an allosteric site in the enterovirus 2C AAA+ ATPase and stabilizes a ring-shaped hexameric complex. Science advances 8 (1) (2022)
Francesca Picarazzi, Marika Zuanon, Gaia Pasqualetto, Silvia Cammarone, Isabella Romeo, Mark T Young, Andrea Brancale, Marcella Bassetto, Mattia Mori
Identification of Small Molecular Chaperones Binding P23H Mutant Opsin through an In Silico Structure-Based Approach. Journal of chemical information and modeling 62 (22) (2022)
Gilda Giancotti, Giulio Nannetti, Gilda Padalino, Martina Landini, Nanci Santos-Ferreira, Jana Van Dycke, Valentina Naccarato, Usheer Patel, Romano Silvestri, Johan Neyts, Roberto Gozalbo-Rovira, Jésus Rodríguez-Díaz, Joana Rocha-Pereira, Andrea Brancale, Salvatore Ferla, Marcella Bassetto
Structural Investigations on Novel Non-Nucleoside Inhibitors of Human Norovirus Polymerase. Viruses 15 (1) (2022)
Thibault Alle, Carmine Varricchio, Yuemang Yao, Bobby Lucero, Goodwell Nzou, Stefania Demuro, Megan Muench, Khoa D Vuong, Killian Oukoloff, Anne-Sophie Cornec, Karol R Francisco, Conor R Caffrey, Virginia M-Y Lee, Amos B Smith Iii, Andrea Brancale, Kurt R Brunden, Carlo Ballatore
Microtubule-Stabilizing 1,2,4-Triazolo[1,5- a ]pyrimidines as Candidate Therapeutics for Neurodegenerative Disease: Matched Molecular Pair Analyses and Computational Studies Reveal New Structure-Activity Insights. Journal of medicinal chemistry 66 (1) (2022)
Gilda Giancotti, Giulio Nannetti, Gilda Padalino, Martina Landini, Nanci Santos-Ferreira, Jana Van Dycke, Valentina Naccarato, Usheer Patel, Romano Silvestri, Johan Neyts, Roberto Gozalbo-Rovira, Jésus Rodríguez-Díaz, Joana Rocha-Pereira, Andrea Brancale, Salvatore Ferla, Marcella Bassetto
Structural Investigations on Novel Non-Nucleoside Inhibitors of Human Norovirus Polymerase. Viruses 15 (1) (2022)
Jitka Soukupová, Cinzia Bordoni, Daniel J Turnham, William W Yang, Gillian Seaton, Aleksandra Gruca, Rhiannon French, Kok Yung Lee, Athina Varnava, Luke Piggott, Richard W E Clarkson, Andrew D Westwell, Andrea Brancale
The Discovery of a Novel Antimetastatic Bcl3 Inhibitor. Molecular cancer therapeutics 20 (5) (2021)
Luís Queirós-Reis, Priscilla Gomes da Silva, José Gonçalves, Andrea Brancale, Marcella Bassetto, João Rodrigo Mesquita
SARS-CoV-2 Virus-Host Interaction: Currently Available Structures and Implications of Variant Emergence on Infectivity and Immune Response. International journal of molecular sciences 22 (19) (2021)
Killian Oukoloff, Goodwell Nzou, Carmine Varricchio, Bobby Lucero, Thibault Alle, Jane Kovalevich, Ludovica Monti, Anne-Sophie Cornec, Yuemang Yao, Michael J James, John Q Trojanowski, Virginia M-Y Lee, Amos B Smith Iii, Andrea Brancale, Kurt R Brunden, Carlo Ballatore
Evaluation of the Structure-Activity Relationship of Microtubule-Targeting 1,2,4-Triazolo[1,5-a]pyrimidines Identifies New Candidates for Neurodegenerative Tauopathies. Journal of medicinal chemistry 64 (2) (2021)
Ben Matthew Flude, Giulio Nannetti, Paige Mitchell, Nina Compton, Chloe Richards, Meike Heurich, Andrea Brancale, Salvatore Ferla, Marcella Bassetto
Targeting the Complement Serine Protease MASP-2 as a Therapeutic Strategy for Coronavirus Infections. Viruses 13 (2) (2021)
Maria Rita Gulotta, Riccardo Brambilla, Perricone Ugo, Andrea Brancale
A Rational Design of α-Helix-Shaped Peptides Employing the Hydrogen-Bond Surrogate Approach: A Modulation Strategy for Ras-RasGRF1 Interaction in Neuropsychiatric Disorders. Pharmaceuticals (Basel, Switzerland) 14 (11) (2021)
Maria Rita Gulotta, Giada De Simone, Justin John, Perricone Ugo, Andrea Brancale
A Computer-Based Methodology to Design Non-Standard Peptides Potentially Able to Prevent HOX-PBX1-Associated Cancer Diseases. International journal of molecular sciences 22 (11) (2021)
Salvatore Ferla, Carmine Varricchio, William Knight, Pui Kei Ho, Fabiana Saporito, Beatrice Tropea, Giulio Fagan, Ben Matthew Flude, Federica Bevilacqua, Nanci Santos-Ferreira, Jana Van Dycke, Johan Neyts, Andrea Brancale, Joana Rocha-Pereira, Marcella Bassetto
Structure-Activity Relationship Studies on Novel Antiviral Agents for Norovirus Infections. Microorganisms 9 (9) (2021)
Lisa Bauer, Roberto Manganaro, Birgit Zonsics, Daniel L Hurdiss, Marleen Zwaagstra, Tim Donselaar, Naemi G E Welter, Regina G D M van Kleef, Moira Lorenzo Lopez, Federica Bevilacqua, Thamidur Raman, Salvatore Ferla, Marcella Bassetto, Johan Neyts, Jeroen R P M Strating, Remco H S Westerink, Andrea Brancale, Frank J M van Kuppeveld
Rational design of highly potent broad-spectrum enterovirus inhibitors targeting the nonstructural protein 2C. PLoS biology 18 (11) (2020)
Gilda Padalino, Iain W Chalmers, Andrea Brancale, Karl F Hoffmann
Identification of 6-(piperazin-1-yl)-1,3,5-triazine as a chemical scaffold with broad anti-schistosomal activities. Wellcome open research 5 (2020)
Marianna Bufano, Marion Laudette, Jean-Paul Blondeau, Frank Lezoualc'h, Marianna Nalli, Romano Silvestri, Andrea Brancale, Antonio Coluccia
Modeling Epac1 interactions with the allosteric inhibitor AM-001 by co-solvent molecular dynamics. Journal of computer-aided molecular design 34 (11) (2020)
Gaia Pasqualetto, Martin Schepelmann, Carmine Varricchio, Elisa Pileggi, Caroline Khogali, Siân R Morgan, Ian Boostrom, Malgorzata Rozanowska, Andrea Brancale, Salvatore Ferla, Marcella Bassetto
Computational Studies towards the Identification of Novel Rhodopsin-Binding Compounds as Chemical Chaperones for Misfolded Opsins. Molecules (Basel, Switzerland) 25 (21) (2020)
Carmine Varricchio, Kathy Beirne, Pascale Aeschlimann, Charles M Heard, Malgorzata Rozanowska, Marcela Votruba, Andrea Brancale
Discovery of Novel 2-Aniline-1,4-naphthoquinones as Potential New Drug Treatment for Leber's Hereditary Optic Neuropathy (LHON). Journal of medicinal chemistry 63 (22) (2020)
Marcella Bassetto, Cecilia M Cima, Mattia Basso, Martina Salerno, Frank Schwarze, Daniela Friese, Joachim J Bugert, Andrea Brancale
Novel Nucleoside Analogues as Effective Antiviral Agents for Zika Virus Infections. Molecules (Basel, Switzerland) 25 (20) (2020)
Melissa G Hewitt, Peter W J Morrison, Hannah M Boostrom, Siân R Morgan, Melissa Fallon, Philip N Lewis, David Whitaker, Andrea Brancale, Carmine Varricchio, Andrew J Quantock, Matthew J Burton, Charles M Heard
In Vitro Topical Delivery of Chlorhexidine to the Cornea: Enhancement Using Drug-Loaded Contact Lenses and β-Cyclodextrin Complexation, and the Importance of Simulating Tear Irrigation. Molecular pharmaceutics 17 (4) (2020)
Gilda Padalino, Iain W Chalmers, Andrea Brancale, Karl F Hoffmann
Identification of 6-(piperazin-1-yl)-1,3,5-triazine as a chemical scaffold with broad anti-schistosomal activities. Wellcome open research (2020)
Cinzia Bordoni, Cecilia Maria Cima, Elisa Azzali, Gabriele Costantino, Andrea Brancale
Microwave-assisted organic synthesis of nucleoside ProTide analogues. RSC advances 9 (35) (2019)
Romeo Romagnoli, Filippo Prencipe, Paola Oliva, Stefania Baraldi, Pier Giovanni Baraldi, Santiago Schiaffino Ortega, Mariem Chayah, Maria Kimatrai Salvador, Luisa Carlota Lopez-Cara, Andrea Brancale, Salvatore Ferla, Ernest Hamel, Roberto Ronca, Roberta Bortolozzi, Elena Mariotto, Elena Mattiuzzo, Giampietro Viola
Design, Synthesis, and Biological Evaluation of 6-Substituted Thieno[3,2- d]pyrimidine Analogues as Dual Epidermal Growth Factor Receptor Kinase and Microtubule Inhibitors. Journal of medicinal chemistry 62 (3) (2019)
Lisa Bauer, Roberto Manganaro, Birgit Zonsics, Jeroen R P M Strating, Priscila El Kazzi, Moira Lorenzo Lopez, Rachel Ulferts, Clara van Hoey, Maria J Maté, Thierry Langer, Bruno Coutard, Andrea Brancale, Frank J M van Kuppeveld
Fluoxetine Inhibits Enterovirus Replication by Targeting the Viral 2C Protein in a Stereospecific Manner. ACS infectious diseases 5 (9) (2019)
Andrea Brancale, Kunwar Shailubhai, Salvatore Ferla, Antonio Ricci, Marcella Bassetto, Gary S Jacob
Therapeutically targeting guanylate cyclase-C: computational modeling of plecanatide, a uroguanylin analog. Pharmacology research & perspectives 5 (2) (2017)