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Journal of Enzyme Inhibition and Medicinal Chemistry Volume 36, 2021 - Issue 1
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Research Paper

Inhibition of α-, β- and γ-carbonic anhydrases from the pathogenic bacterium Vibrio cholerae with aromatic sulphonamides and clinically licenced drugs – a joint docking/molecular dynamics study

Alessandro Bonardia Department NEUROFARBA – Pharmaceutical and Nutraceutical Section; Laboratory of Molecular Modeling Cheminformatics & QSAR, University of Firenze, Sesto Fiorentino, Italy;b Department NEUROFARBA – Pharmaceutical and Nutraceutical Section, University of Firenze, Sesto Fiorentino, ItalyView further author information
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Alessio Nocentinia Department NEUROFARBA – Pharmaceutical and Nutraceutical Section; Laboratory of Molecular Modeling Cheminformatics & QSAR, University of Firenze, Sesto Fiorentino, Italy;b Department NEUROFARBA – Pharmaceutical and Nutraceutical Section, University of Firenze, Sesto Fiorentino, ItalyORCID Iconhttps://orcid.org/0000-0003-3342-702XView further author information
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Sameh Mohamed Osmanc Chemistry Department, College of Science, King Saud University, Riyadh, Saudi ArabiaCorrespondence[email protected]
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Fatmah Ali Alasmaryc Chemistry Department, College of Science, King Saud University, Riyadh, Saudi ArabiaView further author information
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Tahani Mazyad Almutairic Chemistry Department, College of Science, King Saud University, Riyadh, Saudi ArabiaView further author information
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Dalal Saied Abdullahc Chemistry Department, College of Science, King Saud University, Riyadh, Saudi ArabiaView further author information
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Paola Gratteria Department NEUROFARBA – Pharmaceutical and Nutraceutical Section; Laboratory of Molecular Modeling Cheminformatics & QSAR, University of Firenze, Sesto Fiorentino, Italy;b Department NEUROFARBA – Pharmaceutical and Nutraceutical Section, University of Firenze, Sesto Fiorentino, ItalyCorrespondence[email protected]
ORCID Iconhttps://orcid.org/0000-0002-9137-2509View further author information
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Claudiu T. Supuranb Department NEUROFARBA – Pharmaceutical and Nutraceutical Section, University of Firenze, Sesto Fiorentino, ItalyORCID Iconhttps://orcid.org/0000-0003-4262-0323View further author information
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Pages 469-479 | Received 05 Nov 2020, Accepted 01 Dec 2020, Published online: 20 Jan 2021

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Marialuigia Fantacuzzi, Ilaria D’Agostino, Simone Carradori, Francesco Liguori, Fabrizio Carta, Mariangela Agamennone, Andrea Angeli, Filomena Sannio, Jean-Denis Docquier, Clemente Capasso & Claudiu T. Supuran. (2023) Benzenesulfonamide derivatives as Vibrio cholerae carbonic anhydrases inhibitors: a computational-aided insight in the structural rigidity-activity relationships. Journal of Enzyme Inhibition and Medicinal Chemistry 38:1.
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Simone Giovannuzzi, Viviana De Luca, Clemente Capasso & Claudiu T. Supuran. (2023) Inhibition studies with simple and complex (in)organic anions of the γ-carbonic anhydrase from Mammaliicoccus (Staphylococcus) sciuri, MscCAγ. Journal of Enzyme Inhibition and Medicinal Chemistry 38:1.
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Linda J. Urbanski, Daniela Vullo, Seppo Parkkila & Claudiu T. Supuran. (2021) An anion and small molecule inhibition study of the β-carbonic anhydrase from Staphylococcus aureus. Journal of Enzyme Inhibition and Medicinal Chemistry 36:1, pages 1088-1092.
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Alessio Nocentini, Chad S. Hewitt, Margaret D. Mastrolorenzo, Daniel P. Flaherty & Claudiu T. Supuran. (2021) Anion inhibition studies of the α-carbonic anhydrases from Neisseria gonorrhoeae. Journal of Enzyme Inhibition and Medicinal Chemistry 36:1, pages 1061-1066.
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Jennifer M. Colquhoun, Marjan Farokhyfar, Alexander C. Anderson, Christopher R. Bethel, Robert A. Bonomo, Anthony J. Clarke & Philip N. Rather. (2023) Collateral Changes in Cell Physiology Associated with ADC-7 β-Lactamase Expression in Acinetobacter baumannii. Microbiology Spectrum 11:3.
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Jiacheng Guo, Jin Yang, Pei Wang, Bo Guo, Huifang Li, Di Zhang, Faliang An & Song Gao. (2023) Anti-vibriosis bioactive molecules from Arctic Penicillium sp. Z2230. Bioresources and Bioprocessing 10:1.
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Claudiu T. Supuran. 2022. Flavonoids and Phenolics. Flavonoids and Phenolics 298 329 .
Francesca Mancuso, Andrea Angeli, Viviana De Luca, Federica Bucolo, Laura De Luca, Clemente Capasso, Claudiu T. Supuran & Rosaria Gitto. (2022) Synthesis and biological evaluation of sulfonamide‐based compounds as inhibitors of carbonic anhydrase from Vibrio cholerae . Archiv der Pharmazie 355:10, pages 2200070.
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Diaaeldin M. Elimam, Wagdy M. Eldehna, Rofaida Salem, Alessandro Bonardi, Alessio Nocentini, Sara T. Al-Rashood, Mahmoud M. Elaasser, Paola Gratteri, Claudiu T. Supuran & Heba Abdelrasheed Allam. (2022) Natural inspired ligustrazine-based SLC-0111 analogues as novel carbonic anhydrase inhibitors. European Journal of Medicinal Chemistry 228, pages 114008.
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Eva Havránková, Vladimír Garaj, Šárka Mascaretti, Andrea Angeli, Zuzana Soldánová, Miroslav Kemka, Jozef Motyčka, Marie Brázdová, Jozef Csöllei, Josef Jampílek & Claudiu T. Supuran. (2021) Novel 1,3,5-Triazinyl Aminobenzenesulfonamides Incorporating Aminoalcohol, Aminochalcone and Aminostilbene Structural Motifs as Potent Anti-VRE Agents, and Carbonic Anhydrases I, II, VII, IX, and XII Inhibitors. International Journal of Molecular Sciences 23:1, pages 231.
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Neslisah Cihan, G. Bharath, Ashok Kumar Nadda & Ozge YukselOrhan. (2021) A hybrid chemo-biocatalytic system of carbonic anhydrase submerged in CO2-phillic sterically hindered amines for enhanced CO2 capture and conversion into carbonates. International Journal of Greenhouse Gas Control 111, pages 103465.
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