MALUNE, PAOLO
MALUNE, PAOLO
DIPARTIMENTO DI SCIENZE DELLA VITA E DELL'AMBIENTE
A combination of MD-derived pharmacophores and structure-based strategy identifies dual allosteric inhibitors of NS2B-NS3 proteases in Zika and West Nile viruses
2026-01-01 Lupia, Antonio; Nieddu, Salvatore; Demuru, Laura; Sanna, Erica; Onali, Alessia; Emmolo, Roberta; Malune, Paolo; Distinto, Simona; Atzeni, Giulia; Paulis, Annalaura; Meleddu, Rita; Cottiglia, Filippo; Esposito, Francesca; Corona, Angela; Bryant, Sharon D.; Maccioni, Elias; Tramontano, Enzo
Exploring the Pyrimidine Scaffold for the Development of SARSCoV‑2 Mpro Inhibitors
2026-01-01 Nieddu, Salvatore; Ruggieri, G.; De Santis, R.; Malune, Paolo.; Patacchini, E.; Noemi Madia, V.; Saccoliti, F.; Essore, A.; Zarbo, A.; Corona, Angela; Amatore, A.; Grilli, G.; Amoroso, A.; Lista, F.; Tramontano, Enzo; Costi, R.; Di Santo, R.; Esposito, Francesca
Identification of Nsp15 inhibitors restoring interferon-dependent antiviral activity against SARS-CoV-2
2026-01-01 Maloccu, Stefania; Otsuka, Yuka; Molchan, Elizabeth; Foti, Michelle; Paulis, Annalaura; Vishwakarma, Jyoti; Malune, Paolo; Cottiglia, Filippo; Corona, Angela; Scampavia, Louis; Spicer, Timothy P.; Harris, Reuben S.; Tramontano, Enzo; Fanunza, Elisa
γ-Monoalkyl triphosphate analogues of acyclic nucleoside phosphonates inhibit SARS-CoV-2 replication in vitro by inducing dissociation of the minimal replication-transcription complex
2026-01-01 Malune, Paolo; Kullik, G.; Jia, X.; Bandowski, G.; Esposito, Francesca; Lupia, A.; Distinto, S.; Accioni, E.; Meier, C.; Tramontano, Enzo.
Cys44 of SARS-CoV-2 3CLpro affects its catalytic activity
2025-01-01 Iacobucci, I.; Cipollone, I.; Cozzolino, F.; Iaconis, D.; Talarico, C.; Coppola, G.; Morasso, S.; Costanzi, E.; Malune, Paolo; Storici, P.; Tramontano, E.; Esposito, Francesca; Monti, M.
Dual-Site Inhibition of SARS-CoV2 RNA-Dependent RNA Polymerase by Small Molecules Able to Block Viral Replication Identified through a Computer-Aided Drug Discovery Approach
2025-01-01 Malune, Paolo; Iaconis, Daniela; Manelfi, Candida; Giunta, Stefano; Emmolo, Roberta; Lunghini, Filippo; Paulis, Annalaura; Talarico, Carmine; Corona, Angela; Rosario Beccari, Andrea; Tramontano, Enzo; Esposito, Francesca
Identification and Characterization of the Mechanisms of Action of Novel Antiviral Compounds Targeting the Minimal Replication-Transcription Complex of SARS-CoV-2
2025-04-15
The efficiency of high-throughput screening (HTS) and in-silico data analysis during medical emergencies: Identification of effective antiviral 3CLpro inhibitors
2025-01-01 Zian, D.; Iaconis, D.; Nenci, S.; Crusco, A.; Tawde, S.; Sodano, M.; Vitalone, R.; Raje, A.; Palamini, M.; Carettoni, D.; Molteni, A.; Manelfi, C.; Tazzari, V.; Beccari, A. R.; Malune, P.; Maloccu, S.; Paulis, Annalaura; Corona, Angela; Nieddu, Salvatore; Coletti, S.; Scarabottolo, L.; Tramontano, Enzo; Esposito, Francesca; Catalani, M.
Unveiling SARS-CoV-2's heart: role, structure and inhibition of SARS-CoV-2 RNA-dependent RNA polymerase
2025-01-01 Malune, P.; Esposito, Francesca; Tramontano, E.
Drug repurposing screen to identify inhibitors of the RNA polymerase (nsp12) and helicase (nsp13) from SARS-CoV-2 replication and transcription complex
2024-01-01 Kuzikov, Maria; Reinshagen, Jeanette; Wycisk, Krzysztof; Corona, Angela; Esposito, Francesca; Malune, Paolo; Manelfi, Candida; Iaconis, Daniela; Beccari, Andrea; Tramontano, Enzo; Nowotny, Marcin; Windshügel, Bjorn; Gribbon, Philip; Zaliani, Andrea
New Thiazolidine-4-One Derivatives as SARS-CoV-2 Main Protease Inhibitors
2024-01-01 Messore, Antonella; Malune, Paolo; Patacchini, Elisa; Noemi Madia, Valentina; Ialongo, Davide; Arpacioglu, Merve; Albano, Aurora; Ruggieri, Giuseppe; Saccoliti, Francesco; Scipione, Luigi; Tramontano, Enzo; Canton, Serena; Corona, Angela; Scognamiglio, Sante; Paulis, Annalaura; Suleiman, Mustapha; Mohammed Al-Maqtari, Helmi; Abid, Fatma Mohamed A.; Kawsar, Sarkar M. A.; Sankaranarayanan, Murugesan; Di Santo, Roberto; Esposito, Francesca; Roberta Costi, And
Strigolactones as broad-spectrum antivirals against β-coronaviruses through targeting the main protease Mpro
2023-01-01 Biolatti, Matteo; Blangetti, Marco; Baggieri, Melissa; Marchi, Antonella; Gioacchini, Silvia; Bajetto, Greta; Arnodo, Davide; Bucci, Paola; Fioravanti, Raoul; Kojouri, Maedeh; Bersani, Matteo; D’Arrigo, Giulia; Siragusa, Lydia; Ghinato, Simone; De Andre, Marco; Gugliesi, Francesca; Albano, Camilla; Pasquero, Selina; Visentin, Ivan; D’Ugo, Emilio; Esposito, Francesca; Malune, Paolo; Tramontano, Enzo; Prandi, Cristina; Spyrakis, Francesca; Magurano, Fabio; Dell’Oste, Valentina
Targeting SARS-CoV-2 Main Protease: A Successful Story Guided by an In Silico Drug Repurposing Approach
2023-01-01 Alessandra Ambrosio, Francesca; Costa, Giosuè; Romeo, Isabella; Esposito, Francesca; Alkhatib, Mohammad; Salpini, Romina; Svicher, Valentina; Corona, Angela; Malune, Paolo; Tramontano, Enzo; Ceccherini-Silberstein, Francesca; Alcaro, Stefano; Anna Artese, And
| Titolo | Data di pubblicazione | Autore(i) | Rivista | Editore |
|---|---|---|---|---|
| A combination of MD-derived pharmacophores and structure-based strategy identifies dual allosteric inhibitors of NS2B-NS3 proteases in Zika and West Nile viruses | 1-gen-2026 | Lupia, Antonio; Nieddu, Salvatore; Demuru, Laura; Sanna, Erica; Onali, Alessia; Emmolo, Roberta; Malune, Paolo; Distinto, Simona; Atzeni, Giulia; Paulis, Annalaura; Meleddu, Rita; Cottiglia, Filippo; Esposito, Francesca; Corona, Angela; Bryant, Sharon D.; Maccioni, Elias; Tramontano, Enzo | EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY | - |
| Exploring the Pyrimidine Scaffold for the Development of SARSCoV‑2 Mpro Inhibitors | 1-gen-2026 | Nieddu, Salvatore; Ruggieri, G.; De Santis, R.; Malune, Paolo.; Patacchini, E.; Noemi Madia, V.; Saccoliti, F.; Essore, A.; Zarbo, A.; Corona, Angela; Amatore, A.; Grilli, G.; Amoroso, A.; Lista, F.; Tramontano, Enzo; Costi, R.; Di Santo, R.; Esposito, Francesca | ACS INFECTIOUS DISEASES | - |
| Identification of Nsp15 inhibitors restoring interferon-dependent antiviral activity against SARS-CoV-2 | 1-gen-2026 | Maloccu, Stefania; Otsuka, Yuka; Molchan, Elizabeth; Foti, Michelle; Paulis, Annalaura; Vishwakarma, Jyoti; Malune, Paolo; Cottiglia, Filippo; Corona, Angela; Scampavia, Louis; Spicer, Timothy P.; Harris, Reuben S.; Tramontano, Enzo; Fanunza, Elisa | ANTIVIRAL RESEARCH | - |
| γ-Monoalkyl triphosphate analogues of acyclic nucleoside phosphonates inhibit SARS-CoV-2 replication in vitro by inducing dissociation of the minimal replication-transcription complex | 1-gen-2026 | Malune, Paolo; Kullik, G.; Jia, X.; Bandowski, G.; Esposito, Francesca; Lupia, A.; Distinto, S.; Accioni, E.; Meier, C.; Tramontano, Enzo. | ANTIVIRAL RESEARCH | - |
| Cys44 of SARS-CoV-2 3CLpro affects its catalytic activity | 1-gen-2025 | Iacobucci, I.; Cipollone, I.; Cozzolino, F.; Iaconis, D.; Talarico, C.; Coppola, G.; Morasso, S.; Costanzi, E.; Malune, Paolo; Storici, P.; Tramontano, E.; Esposito, Francesca; Monti, M. | INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES | - |
| Dual-Site Inhibition of SARS-CoV2 RNA-Dependent RNA Polymerase by Small Molecules Able to Block Viral Replication Identified through a Computer-Aided Drug Discovery Approach | 1-gen-2025 | Malune, Paolo; Iaconis, Daniela; Manelfi, Candida; Giunta, Stefano; Emmolo, Roberta; Lunghini, Filippo; Paulis, Annalaura; Talarico, Carmine; Corona, Angela; Rosario Beccari, Andrea; Tramontano, Enzo; Esposito, Francesca | ACS INFECTIOUS DISEASES | - |
| Identification and Characterization of the Mechanisms of Action of Novel Antiviral Compounds Targeting the Minimal Replication-Transcription Complex of SARS-CoV-2 | 15-apr-2025 | - | - | Università degli Studi di Cagliari |
| The efficiency of high-throughput screening (HTS) and in-silico data analysis during medical emergencies: Identification of effective antiviral 3CLpro inhibitors | 1-gen-2025 | Zian, D.; Iaconis, D.; Nenci, S.; Crusco, A.; Tawde, S.; Sodano, M.; Vitalone, R.; Raje, A.; Palamini, M.; Carettoni, D.; Molteni, A.; Manelfi, C.; Tazzari, V.; Beccari, A. R.; Malune, P.; Maloccu, S.; Paulis, Annalaura; Corona, Angela; Nieddu, Salvatore; Coletti, S.; Scarabottolo, L.; Tramontano, Enzo; Esposito, Francesca; Catalani, M. | ANTIVIRAL RESEARCH | - |
| Unveiling SARS-CoV-2's heart: role, structure and inhibition of SARS-CoV-2 RNA-dependent RNA polymerase | 1-gen-2025 | Malune, P.; Esposito, Francesca; Tramontano, E. | ANTIVIRAL RESEARCH | - |
| Drug repurposing screen to identify inhibitors of the RNA polymerase (nsp12) and helicase (nsp13) from SARS-CoV-2 replication and transcription complex | 1-gen-2024 | Kuzikov, Maria; Reinshagen, Jeanette; Wycisk, Krzysztof; Corona, Angela; Esposito, Francesca; Malune, Paolo; Manelfi, Candida; Iaconis, Daniela; Beccari, Andrea; Tramontano, Enzo; Nowotny, Marcin; Windshügel, Bjorn; Gribbon, Philip; Zaliani, Andrea | VIRUS RESEARCH | - |
| New Thiazolidine-4-One Derivatives as SARS-CoV-2 Main Protease Inhibitors | 1-gen-2024 | Messore, Antonella; Malune, Paolo; Patacchini, Elisa; Noemi Madia, Valentina; Ialongo, Davide; Arpacioglu, Merve; Albano, Aurora; Ruggieri, Giuseppe; Saccoliti, Francesco; Scipione, Luigi; Tramontano, Enzo; Canton, Serena; Corona, Angela; Scognamiglio, Sante; Paulis, Annalaura; Suleiman, Mustapha; Mohammed Al-Maqtari, Helmi; Abid, Fatma Mohamed A.; Kawsar, Sarkar M. A.; Sankaranarayanan, Murugesan; Di Santo, Roberto; Esposito, Francesca; Roberta Costi, And | PHARMACEUTICALS | - |
| Strigolactones as broad-spectrum antivirals against β-coronaviruses through targeting the main protease Mpro | 1-gen-2023 | Biolatti, Matteo; Blangetti, Marco; Baggieri, Melissa; Marchi, Antonella; Gioacchini, Silvia; Bajetto, Greta; Arnodo, Davide; Bucci, Paola; Fioravanti, Raoul; Kojouri, Maedeh; Bersani, Matteo; D’Arrigo, Giulia; Siragusa, Lydia; Ghinato, Simone; De Andre, Marco; Gugliesi, Francesca; Albano, Camilla; Pasquero, Selina; Visentin, Ivan; D’Ugo, Emilio; Esposito, Francesca; Malune, Paolo; Tramontano, Enzo; Prandi, Cristina; Spyrakis, Francesca; Magurano, Fabio; Dell’Oste, Valentina | ACS INFECTIOUS DISEASES | - |
| Targeting SARS-CoV-2 Main Protease: A Successful Story Guided by an In Silico Drug Repurposing Approach | 1-gen-2023 | Alessandra Ambrosio, Francesca; Costa, Giosuè; Romeo, Isabella; Esposito, Francesca; Alkhatib, Mohammad; Salpini, Romina; Svicher, Valentina; Corona, Angela; Malune, Paolo; Tramontano, Enzo; Ceccherini-Silberstein, Francesca; Alcaro, Stefano; Anna Artese, And | JOURNAL OF CHEMICAL INFORMATION AND MODELING | - |