Structural Insight into Potent Broad-Spectrum Inhibition with Reversible Recyclization Mechanism: Avibactam in Complex with CTX-M-15 and Pseudomonas aeruginosa AmpC β-Lactamases
LAHIRI, Sushmita D, MANGANI, Stefano, DURAND-REVILLE, Thomas, BENVENUTI, Manuela, DE LUCA, Filomena, SANYAL, Gautam, DOCQUIER, Jean-Denis
Published in Antimicrobial Agents and Chemotherapy (01.06.2013)
Published in Antimicrobial Agents and Chemotherapy (01.06.2013)
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Intermolecular interactions of the extended recognition site of VIM‐2 metallo‐β‐lactamase with 1,2,4‐triazole‐3‐thione inhibitors. Validations of a polarizable molecular mechanics potential by ab initio QC
Kwapien, Karolina, Gavara, Laurent, Docquier, Jean‐Denis, Berthomieu, Dorothée, Hernandez, Jean‐François, Gresh, Nohad
Published in Journal of computational chemistry (15.01.2021)
Published in Journal of computational chemistry (15.01.2021)
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Towards Innovative Antibacterial Correctors for Cystic Fibrosis Targeting the Lung Microbiome with a Multifunctional Effect
Martina, Maria Grazia, Sannio, Filomena, Crespan, Emmanuele, Pavone, Marialaura, Simoncini, Alice, Barbieri, Francesca, Perini, Cecilia, Pesce, Emanuela, Maga, Giovanni, Pedemonte, Nicoletta, Docquier, Jean‐Denis, Radi, Marco
Published in ChemMedChem (05.09.2022)
Published in ChemMedChem (05.09.2022)
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Peptaibol Analogs Show Potent Antibacterial Activity against Multidrug Resistant Opportunistic Pathogens
Dalla Torre, Chiara, Sannio, Filomena, Battistella, Mattia, Docquier, Jean-Denis, De Zotti, Marta
Published in International journal of molecular sciences (28.04.2023)
Published in International journal of molecular sciences (28.04.2023)
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Benzenesulfonamide derivatives as Vibrio cholerae carbonic anhydrases inhibitors: a computational-aided insight in the structural rigidity-activity relationships
Fantacuzzi, Marialuigia, D'Agostino, Ilaria, Carradori, Simone, Liguori, Francesco, Carta, Fabrizio, Agamennone, Mariangela, Angeli, Andrea, Sannio, Filomena, Docquier, Jean-Denis, Capasso, Clemente, Supuran, Claudiu T.
Published in Journal of enzyme inhibition and medicinal chemistry (01.12.2023)
Published in Journal of enzyme inhibition and medicinal chemistry (01.12.2023)
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1,2,4‐Triazole‐3‐Thione Analogues with a 2‐Ethylbenzoic Acid at Position 4 as VIM‐type Metallo‐β‐Lactamase Inhibitors
Verdirosa, Federica, Gavara, Laurent, Sevaille, Laurent, Tassone, Giusy, Corsica, Giuseppina, Legru, Alice, Feller, Georges, Chelini, Giulia, Mercuri, Paola Sandra, Tanfoni, Silvia, Sannio, Filomena, Benvenuti, Manuela, Cerboni, Giulia, De Luca, Filomena, Bouajila, Ezeddine, Vo Hoang, Yen, Licznar‐Fajardo, Patricia, Galleni, Moreno, Pozzi, Cecilia, Mangani, Stefano, Docquier, Jean‐Denis, Hernandez, Jean‐François
Published in ChemMedChem (05.04.2022)
Published in ChemMedChem (05.04.2022)
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FIM-1, a New Acquired Metallo-β-Lactamase from a Pseudomonas aeruginosa Clinical Isolate from Italy
POLLINI, Simona, MARADEI, Simona, PECILE, Patrizia, OLIVO, Giuseppe, LUZZARO, Francesco, DOCQUIER, Jean-Denis, GIAN MARIA ROSSOLINI
Published in Antimicrobial Agents and Chemotherapy (01.01.2013)
Published in Antimicrobial Agents and Chemotherapy (01.01.2013)
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4-Trifluoromethyl bithiazoles as broad-spectrum antimicrobial agents for virus-related bacterial infections or co-infections
Barbieri, Francesca, Carlen, Vincent, Martina, Maria Grazia, Sannio, Filomena, Cancade, Sacha, Perini, Cecilia, Restori, Margherita, Crespan, Emmanuele, Maga, Giovanni, Docquier, Jean-Denis, Cagno, Valeria, Radi, Marco
Published in MedChemComm (22.05.2024)
Published in MedChemComm (22.05.2024)
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Virtual screening identifies broad-spectrum β-lactamase inhibitors with activity on clinically relevant serine- and metallo-carbapenemases
Spyrakis, Francesca, Santucci, Matteo, Maso, Lorenzo, Cross, Simon, Gianquinto, Eleonora, Sannio, Filomena, Verdirosa, Federica, De Luca, Filomena, Docquier, Jean-Denis, Cendron, Laura, Tondi, Donatella, Venturelli, Alberto, Cruciani, Gabriele, Costi, Maria Paola
Published in Scientific reports (29.07.2020)
Published in Scientific reports (29.07.2020)
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Computational and biological profile of boronic acids for the detection of bacterial serine- and metallo-β-lactamases
Santucci, Matteo, Spyrakis, Francesca, Cross, Simon, Quotadamo, Antonio, Farina, Davide, Tondi, Donatella, De Luca, Filomena, Docquier, Jean-Denis, Prieto, Ana Isabel, Ibacache, Claudia, Blázquez, Jesús, Venturelli, Alberto, Cruciani, Gabriele, Costi, Maria Paola
Published in Scientific reports (18.12.2017)
Published in Scientific reports (18.12.2017)
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Editorial: Structural and Biochemical Aspects of the Interaction of β-Lactamases With State-of-the-Art Inhibitors
Papp-Wallace, Krisztina M, Docquier, Jean-Denis, Kerff, Frederic, Power, Pablo
Published in Frontiers in microbiology (02.02.2022)
Published in Frontiers in microbiology (02.02.2022)
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Novel Acquired Metallo-β-Lactamase Gene, blaSIM-1, in a Class 1 Integron from Acinetobacter baumannii Clinical Isolates from Korea
Lee, Kyungwon, Yum, Jong Hwa, Yong, Dongeun, Lee, Hyuk Min, Kim, Heung Dong, Docquier, Jean-Denis, Rossolini, Gian Maria, Chong, Yunsop
Published in Antimicrobial Agents and Chemotherapy (01.11.2005)
Published in Antimicrobial Agents and Chemotherapy (01.11.2005)
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Type M Resistance to Macrolides Is Due to a Two-Gene Efflux Transport System of the ATP-Binding Cassette (ABC) Superfamily
Iannelli, Francesco, Santoro, Francesco, Santagati, Maria, Docquier, Jean-Denis, Lazzeri, Elisa, Pastore, Gabiria, Cassone, Marco, Oggioni, Marco R, Rossolini, Gian M, Stefani, Stefania, Pozzi, Gianni
Published in Frontiers in microbiology (31.07.2018)
Published in Frontiers in microbiology (31.07.2018)
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An update on β-lactamase inhibitor discovery and development
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Structure-Based Optimization of 1,2,4-Triazole-3-Thione Derivatives: Improving Inhibition of NDM-/VIM-Type Metallo-β-Lactamases and Synergistic Activity on Resistant Bacteria
Bersani, Matteo, Failla, Mariacristina, Vascon, Filippo, Gianquinto, Eleonora, Bertarini, Laura, Baroni, Massimo, Cruciani, Gabriele, Verdirosa, Federica, Sannio, Filomena, Docquier, Jean-Denis, Cendron, Laura, Spyrakis, Francesca, Lazzarato, Loretta, Tondi, Donatella
Published in Pharmaceuticals (Basel, Switzerland) (01.12.2023)
Published in Pharmaceuticals (Basel, Switzerland) (01.12.2023)
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1,2,4‐Triazole‐3‐thione Compounds as Inhibitors of Dizinc Metallo‐β‐lactamases
Sevaille, Laurent, Gavara, Laurent, Bebrone, Carine, De Luca, Filomena, Nauton, Lionel, Achard, Maud, Mercuri, Paola, Tanfoni, Silvia, Borgianni, Luisa, Guyon, Carole, Lonjon, Pauline, Turan‐Zitouni, Gülhan, Dzieciolowski, Julia, Becker, Katja, Bénard, Lionel, Condon, Ciaran, Maillard, Ludovic, Martinez, Jean, Frère, Jean‐Marie, Dideberg, Otto, Galleni, Moreno, Docquier, Jean‐Denis, Hernandez, Jean‐François
Published in ChemMedChem (21.06.2017)
Published in ChemMedChem (21.06.2017)
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Deciphering Multifactorial Resistance Phenotypes in Acinetobacter baumannii by Genomics and Targeted Label-free Proteomics
Cecchini, Tiphaine, Yoon, Eun-Jeong, Charretier, Yannick, Bardet, Chloé, Beaulieu, Corinne, Lacoux, Xavier, Docquier, Jean-Denis, Lemoine, Jerome, Courvalin, Patrice, Grillot-Courvalin, Catherine, Charrier, Jean-Philippe
Published in Molecular & cellular proteomics (01.03.2018)
Published in Molecular & cellular proteomics (01.03.2018)
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Evolution to carbapenem-hydrolyzing activity in noncarbapenemase class D β-lactamase OXA-10 by rational protein design
De Luca, Filomena, Benvenuti, Manuela, Carboni, Filippo, Pozzi, Cecilia, Rossolini, Gian Maria, Mangani, Stefano, Docquier, Jean-Denis
Published in Proceedings of the National Academy of Sciences - PNAS (08.11.2011)
Published in Proceedings of the National Academy of Sciences - PNAS (08.11.2011)
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Discovering NDM-1 inhibitors using molecular substructure embeddings representations
Papastergiou, Thomas, Azé, Jérôme, Bringay, Sandra, Louet, Maxime, Poncelet, Pascal, Rosales-Hurtado, Miyanou, Vo-Hoang, Yen, Licznar-Fajardo, Patricia, Docquier, Jean-Denis, Gavara, Laurent
Published in Journal of integrative bioinformatics (28.07.2023)
Published in Journal of integrative bioinformatics (28.07.2023)
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