MANGIATORDI, GIUSEPPE FELICE
MANGIATORDI, GIUSEPPE FELICE
Istituto di Cristallografia - IC
Conformational Restriction of Designer Drugs Reveals Subtype-Selective and Biased CB2 Agonists with Neuroprotective Effects
2025 Gioé-Gallo, Claudia; Ortigueira, Sandra; Prieto-Díaz, Rubén; Contino, Marialessandra; Azuaje, Jhonny; Perrone, Maria Grazia; Riganti, Chiara; Alberga, Domenico; Mangiatordi, Giuseppe Felice; Andújar-Arias, Antonio; García-Rey, Aitor; Graziano, Giovanni; Stefanachi, Angela; Val, Cristina; Martínez, Antón Leandro; Rebassa, Joan Biel; Reza, David; Selas, Asier; Francavilla, Fabio; Paleo, M. Rita; García-Mera, Xerardo; Loza, M. Isabel; Navarro, Gemma; Brea, José; Sotelo, Eddy
Discovery and Structural Characterization of a Novel Polymorph (Form III) of Alclometasone Dipropionate
2025 Lopopolo, Gianfranco; Papadopoulos, M. Giovanna E.; Cuocci, Corrado; Mangiatordi, Giuseppe F.; Lopalco, Antonio; Attolino, Emanuele; Rizzi, Rosanna
Hunting for lubeluzole analogues as antimyotonic agents with reduced cardiac liability
2025 Cavalluzzi, Maria Maddalena; Gualdani, Roberta; Farinato, Alessandro; Altamura, Concetta; Pierno, Sabata; Rotondo, Natalie Paola; Terlizzi, Francesco; Mattioli, Laura Beatrice; Perrone, Maria Grazia; Lomuscio, Maria Cristina; Mangiatordi, Giuseppe Felice; Colabufo, Nicola Antonio; Carrieri, Antonio; Budriesi, Roberta; Gmeiner, Peter; Huebner, Harald; Desaphy, Jean-François; Lentini, Giovanni
Identification of a Cannabinoid Receptor 2 Allosteric Site Using Computational Modeling and Pharmacological Analysis
2025 Farooq, Z.; Delre, P.; Iliadis, S.; Mangiatordi, G. F.; Contino, M.; Howell, L. A.; Mccormick, P. J.
In Vitro Evaluation of Novel Furo[3,2-c]coumarins as Cholinesterases and Monoamine Oxidases Inhibitors
2025 Rullo, M.; Benzi, A.; Bianchi, L.; Maccagno, M.; Marcantoni Taddei, G.; Miniero, D. V.; Mangiatordi, G. F.; Lentini, G.; Pisani, L.; Petrillo, G.; Tavani, C.
Shedding light on the HSAB-guided sulfur–selenium antagonism in mercury coordination and reactivity toward biologically relevant systems: a DFT and MD study
2025 Delre, Pietro; Chahine, Ali; Mangiatordi, Giuseppe Felice; Alberga, Domenico; Saviano, Michele; Valverdu, Germain; Ronga, Luisa; Miqueu, Karinne; Karamanis, Panaghiotis
Structural Implications of Missense Point Mutations in Shwachman–Bodian–Diamond Syndrome Protein (SBDS): A Combined SAXS/MD Investigation
2025 Mattiotti, Giovanni; Nanna, Vittoria; Giulini, Marco; Alberga, Domenico; Mangiatordi, Giuseppe Felice; Sánchez-Puig, Nuria; Saviano, Michele; Tubiana, Luca; Potestio, Raffaello; Lattanzi, Gianluca; Siliqi, Dritan
Structure-based identification of a non-covalent thioredoxin reductase inhibitor with proven ADMET suitability
2025 Lamanna, G.; Augello, G.; Ronga, L.; Tesauro, D.; Silvestri, I.; Azzolina, A.; Cervello, M.; Mangiatordi, G. F.; Saviano, M.
Transformer Decoder Learns from a Pretrained Protein Language Model to Generate Ligands with High Affinity
2025 Creanza, T. M.; Alberga, D.; Patruno, C.; Mangiatordi, G. F.; Ancona, N.
β-Cyclodextrin Inclusion Complexes with Model Pentapeptides: Role of the Tyrosine Position within the Peptide Chain
2025 Dragone, M.; D'Abrosca, G.; D'Aniello, A.; Alberga, D.; Shitaye, G.; Grazioso, R.; Tomassi, S.; Russo, L.; Fattorusso, R.; Di Maro, S.; Mangiatordi, G. F.; Saviano, M.; Malgieri, G.; Isernia, C.; Iacovino, R.
A CD Study of a Structure-Based Selection of N-Heterocyclic Bis-Carbene Gold(I) Complexes as Potential Ligands of the G-Quadruplex-Forming Human Telomeric hTel23 Sequence
2024 Marzano, Maria; Prencipe, Filippo; Delre, Pietro; Mangiatordi, Giuseppe Felice; Travagliante, Gabriele; Ronga, Luisa; Piccialli, Gennaro; Saviano, Michele; D'Errico, Stefano; Tesauro, Diego; Oliviero, Giorgia
DeLA-DrugSelf: Empowering Multi-Objective De Novo Design through SELFIES Molecular Representation
2024 Alberga, Domenico; Lamanna, Giuseppe; Graziano, Giovanni; Delre, Pietro; Cristina Lomuscio, Maria; Corriero, Nicola; Ligresti, Alessia; Siliqi, Dritan; Saviano, Michele; Contino, Marialessandra; Stefanachi, Angela; Mangiatordi, GIUSEPPE FELICE
Development of a recombinant human IgG1 monoclonal antibody against the TRBV5-1 segment of the T cell receptor for the treatment of mature T cell neoplasms
2024 Pitaro, M.; Antonini, G.; Arcovito, A.; Buccisano, F.; De Lauro, A.; Irno Consalvo, M.; Gallo, V.; Giacon, N.; Mangiatordi, G. F.; Pacelli, M.; Pitaro, M. T.; Polticelli, F.; Sorrenti, M.; Venditti, A.
DypB peroxidase for aflatoxin removal: New insights into the toxin degradation process
2024 Mangini, V; Rosini, E; Caliandro, R; Mangiatordi, Gf; Delre, P; Sciancalepore, Ag; Pollegioni, L; Haidukowski, M; Mazzorana, M; Sumarah, Mw; Renaud, Jb; Flaig, R; Mulè, G; Belviso, Bd; Loi, M
Molecular interactions between a diphenyl scaffold and PED/PEA15: Implications for type II diabetes therapeutics targeting PED/PEA15 - Phospholipase D1 interaction
2024 Mercurio, Ivan; D'Abrosca, Gianluca; Della Valle, Maria; Malgieri, Gaetano; Fattorusso, Roberto; Isernia, Carla; Russo, Luigi; Di Gaetano, Sonia; Pedone, Emilia Maria; Pirone, Luciano; Del Gatto, Annarita; Zaccaro, Laura; Alberga, Domenico; Saviano, Michele; Mangiatordi, Giuseppe Felice
N-Adamantyl-1-alkyl-4-oxo-1,4-dihydroquinoline-3-carboxamide Derivatives as Fluorescent Probes to Detect Microglia Activation through the Imaging of Cannabinoid Receptor Subtype 2 (CB2R)
2024 Intranuovo, F; Majellaro, M; Mastropasqua, F; Delre, P; Abatematteo, Fs; Mangiatordi, Gf; Stefanachi, A; Brea, J; Loza, Mi; Riganti, C; Ligresti, A; Kumar, P; Esposito, D; Cristino, L; Nicois, A; González, L; Perrone, Mg; Colabufo, Na; Sotelo, E; Abate, C; Contino, M.
SIGMAP: an explainable artificial intelligence tool for SIGMA-1 receptor affinity prediction
2024 Lomuscio, Maria Cristina; Corriero, Nicola; Nanna, Vittoria; Piccinno, Antonio; Saviano, Michele; Lanzilotti, Rosa; Abate, Carmen; Alberga, Domenico; Mangiatordi, Giuseppe Felice
Structural basis for specific inhibition of salicylate synthase from Mycobacterium abscessus
2024 Mori, Matteo; Cocorullo, Mario; Tresoldi, Andrea; Cazzaniga, Giulia; Gelain, Arianna; Stelitano, Giovanni; Chiarelli, Laurent R.; Tomaiuolo, Martina; Delre, Pietro; Mangiatordi, Giuseppe F.; Garofalo, Mariangela; Cassetta, Alberto; Covaceuszach, Sonia; Villa, Stefania; Meneghetti, Fiorella
Structure-based design of multitargeting ChEs-MAO B inhibitors based on phenyl ring bioisosteres: AChE/BChE selectivity switch and drug-like characterization
2024 La Spada, Gabriella; Miniero, Daniela Valeria; Rullo, Mariagrazia; Cipolloni, Marco; Delre, Pietro; Colliva, Carolina; Colella, Marco; Leonetti, Francesco; Liuzzi, Grazia Maria; Mangiatordi, Giuseppe Felice; Giacchè, Nicola; Pisani, Leonardo
A conformational rearrangement of the SARS-CoV-2 host protein sigma-1 is required for antiviral activity: insights from a combined in-silico/in-vitro approach
2023 Abatematteo Francesca, Serena; Delre, Pietro; Mercurio, Ivan; Rezelj Veronica, V; Siliqi, Dritan; Beaucourt, Stephanie; Lattanzi, Gianluca; Colabufo Nicola, Antonio; Leopoldo, Marcello; Saviano, Michele; Vignuzzi, Marco; Mangiatordi, GIUSEPPE FELICE; Abate, Carmen
| Titolo | Data di pubblicazione | Autore(i) | File |
|---|---|---|---|
| Conformational Restriction of Designer Drugs Reveals Subtype-Selective and Biased CB2 Agonists with Neuroprotective Effects | 1-gen-2025 | Gioé-Gallo, Claudia; Ortigueira, Sandra; Prieto-Díaz, Rubén; Contino, Marialessandra; Azuaje, Jhonny; Perrone, Maria Grazia; Riganti, Chiara; Alberga, Domenico; Mangiatordi, Giuseppe Felice; Andújar-Arias, Antonio; García-Rey, Aitor; Graziano, Giovanni; Stefanachi, Angela; Val, Cristina; Martínez, Antón Leandro; Rebassa, Joan Biel; Reza, David; Selas, Asier; Francavilla, Fabio; Paleo, M. Rita; García-Mera, Xerardo; Loza, M. Isabel; Navarro, Gemma; Brea, José; Sotelo, Eddy | |
| Discovery and Structural Characterization of a Novel Polymorph (Form III) of Alclometasone Dipropionate | 1-gen-2025 | Lopopolo, Gianfranco; Papadopoulos, M. Giovanna E.; Cuocci, Corrado; Mangiatordi, Giuseppe F.; Lopalco, Antonio; Attolino, Emanuele; Rizzi, Rosanna | |
| Hunting for lubeluzole analogues as antimyotonic agents with reduced cardiac liability | 1-gen-2025 | Cavalluzzi, Maria Maddalena; Gualdani, Roberta; Farinato, Alessandro; Altamura, Concetta; Pierno, Sabata; Rotondo, Natalie Paola; Terlizzi, Francesco; Mattioli, Laura Beatrice; Perrone, Maria Grazia; Lomuscio, Maria Cristina; Mangiatordi, Giuseppe Felice; Colabufo, Nicola Antonio; Carrieri, Antonio; Budriesi, Roberta; Gmeiner, Peter; Huebner, Harald; Desaphy, Jean-François; Lentini, Giovanni | |
| Identification of a Cannabinoid Receptor 2 Allosteric Site Using Computational Modeling and Pharmacological Analysis | 1-gen-2025 | Farooq, Z.; Delre, P.; Iliadis, S.; Mangiatordi, G. F.; Contino, M.; Howell, L. A.; Mccormick, P. J. | |
| In Vitro Evaluation of Novel Furo[3,2-c]coumarins as Cholinesterases and Monoamine Oxidases Inhibitors | 1-gen-2025 | Rullo, M.; Benzi, A.; Bianchi, L.; Maccagno, M.; Marcantoni Taddei, G.; Miniero, D. V.; Mangiatordi, G. F.; Lentini, G.; Pisani, L.; Petrillo, G.; Tavani, C. | |
| Shedding light on the HSAB-guided sulfur–selenium antagonism in mercury coordination and reactivity toward biologically relevant systems: a DFT and MD study | 1-gen-2025 | Delre, Pietro; Chahine, Ali; Mangiatordi, Giuseppe Felice; Alberga, Domenico; Saviano, Michele; Valverdu, Germain; Ronga, Luisa; Miqueu, Karinne; Karamanis, Panaghiotis | |
| Structural Implications of Missense Point Mutations in Shwachman–Bodian–Diamond Syndrome Protein (SBDS): A Combined SAXS/MD Investigation | 1-gen-2025 | Mattiotti, Giovanni; Nanna, Vittoria; Giulini, Marco; Alberga, Domenico; Mangiatordi, Giuseppe Felice; Sánchez-Puig, Nuria; Saviano, Michele; Tubiana, Luca; Potestio, Raffaello; Lattanzi, Gianluca; Siliqi, Dritan | |
| Structure-based identification of a non-covalent thioredoxin reductase inhibitor with proven ADMET suitability | 1-gen-2025 | Lamanna, G.; Augello, G.; Ronga, L.; Tesauro, D.; Silvestri, I.; Azzolina, A.; Cervello, M.; Mangiatordi, G. F.; Saviano, M. | |
| Transformer Decoder Learns from a Pretrained Protein Language Model to Generate Ligands with High Affinity | 1-gen-2025 | Creanza, T. M.; Alberga, D.; Patruno, C.; Mangiatordi, G. F.; Ancona, N. | |
| β-Cyclodextrin Inclusion Complexes with Model Pentapeptides: Role of the Tyrosine Position within the Peptide Chain | 1-gen-2025 | Dragone, M.; D'Abrosca, G.; D'Aniello, A.; Alberga, D.; Shitaye, G.; Grazioso, R.; Tomassi, S.; Russo, L.; Fattorusso, R.; Di Maro, S.; Mangiatordi, G. F.; Saviano, M.; Malgieri, G.; Isernia, C.; Iacovino, R. | |
| A CD Study of a Structure-Based Selection of N-Heterocyclic Bis-Carbene Gold(I) Complexes as Potential Ligands of the G-Quadruplex-Forming Human Telomeric hTel23 Sequence | 1-gen-2024 | Marzano, Maria; Prencipe, Filippo; Delre, Pietro; Mangiatordi, Giuseppe Felice; Travagliante, Gabriele; Ronga, Luisa; Piccialli, Gennaro; Saviano, Michele; D'Errico, Stefano; Tesauro, Diego; Oliviero, Giorgia | |
| DeLA-DrugSelf: Empowering Multi-Objective De Novo Design through SELFIES Molecular Representation | 1-gen-2024 | Alberga, Domenico; Lamanna, Giuseppe; Graziano, Giovanni; Delre, Pietro; Cristina Lomuscio, Maria; Corriero, Nicola; Ligresti, Alessia; Siliqi, Dritan; Saviano, Michele; Contino, Marialessandra; Stefanachi, Angela; Mangiatordi, GIUSEPPE FELICE | |
| Development of a recombinant human IgG1 monoclonal antibody against the TRBV5-1 segment of the T cell receptor for the treatment of mature T cell neoplasms | 1-gen-2024 | Pitaro, M.; Antonini, G.; Arcovito, A.; Buccisano, F.; De Lauro, A.; Irno Consalvo, M.; Gallo, V.; Giacon, N.; Mangiatordi, G. F.; Pacelli, M.; Pitaro, M. T.; Polticelli, F.; Sorrenti, M.; Venditti, A. | |
| DypB peroxidase for aflatoxin removal: New insights into the toxin degradation process | 1-gen-2024 | Mangini, V; Rosini, E; Caliandro, R; Mangiatordi, Gf; Delre, P; Sciancalepore, Ag; Pollegioni, L; Haidukowski, M; Mazzorana, M; Sumarah, Mw; Renaud, Jb; Flaig, R; Mulè, G; Belviso, Bd; Loi, M | |
| Molecular interactions between a diphenyl scaffold and PED/PEA15: Implications for type II diabetes therapeutics targeting PED/PEA15 - Phospholipase D1 interaction | 1-gen-2024 | Mercurio, Ivan; D'Abrosca, Gianluca; Della Valle, Maria; Malgieri, Gaetano; Fattorusso, Roberto; Isernia, Carla; Russo, Luigi; Di Gaetano, Sonia; Pedone, Emilia Maria; Pirone, Luciano; Del Gatto, Annarita; Zaccaro, Laura; Alberga, Domenico; Saviano, Michele; Mangiatordi, Giuseppe Felice | |
| N-Adamantyl-1-alkyl-4-oxo-1,4-dihydroquinoline-3-carboxamide Derivatives as Fluorescent Probes to Detect Microglia Activation through the Imaging of Cannabinoid Receptor Subtype 2 (CB2R) | 1-gen-2024 | Intranuovo, F; Majellaro, M; Mastropasqua, F; Delre, P; Abatematteo, Fs; Mangiatordi, Gf; Stefanachi, A; Brea, J; Loza, Mi; Riganti, C; Ligresti, A; Kumar, P; Esposito, D; Cristino, L; Nicois, A; González, L; Perrone, Mg; Colabufo, Na; Sotelo, E; Abate, C; Contino, M. | |
| SIGMAP: an explainable artificial intelligence tool for SIGMA-1 receptor affinity prediction | 1-gen-2024 | Lomuscio, Maria Cristina; Corriero, Nicola; Nanna, Vittoria; Piccinno, Antonio; Saviano, Michele; Lanzilotti, Rosa; Abate, Carmen; Alberga, Domenico; Mangiatordi, Giuseppe Felice | |
| Structural basis for specific inhibition of salicylate synthase from Mycobacterium abscessus | 1-gen-2024 | Mori, Matteo; Cocorullo, Mario; Tresoldi, Andrea; Cazzaniga, Giulia; Gelain, Arianna; Stelitano, Giovanni; Chiarelli, Laurent R.; Tomaiuolo, Martina; Delre, Pietro; Mangiatordi, Giuseppe F.; Garofalo, Mariangela; Cassetta, Alberto; Covaceuszach, Sonia; Villa, Stefania; Meneghetti, Fiorella | |
| Structure-based design of multitargeting ChEs-MAO B inhibitors based on phenyl ring bioisosteres: AChE/BChE selectivity switch and drug-like characterization | 1-gen-2024 | La Spada, Gabriella; Miniero, Daniela Valeria; Rullo, Mariagrazia; Cipolloni, Marco; Delre, Pietro; Colliva, Carolina; Colella, Marco; Leonetti, Francesco; Liuzzi, Grazia Maria; Mangiatordi, Giuseppe Felice; Giacchè, Nicola; Pisani, Leonardo | |
| A conformational rearrangement of the SARS-CoV-2 host protein sigma-1 is required for antiviral activity: insights from a combined in-silico/in-vitro approach | 1-gen-2023 | Abatematteo Francesca, Serena; Delre, Pietro; Mercurio, Ivan; Rezelj Veronica, V; Siliqi, Dritan; Beaucourt, Stephanie; Lattanzi, Gianluca; Colabufo Nicola, Antonio; Leopoldo, Marcello; Saviano, Michele; Vignuzzi, Marco; Mangiatordi, GIUSEPPE FELICE; Abate, Carmen |