Carosati, Emanuele
Carosati, Emanuele
Dipartimento di Scienze Chimiche e Farmaceutiche
Settore CHIM/08 - Chimica Farmaceutica
Docenti di ruolo di IIa fascia
1,4-Dihydropyridine scaffold in medicinal chemistry, the story so far and perspectives (part 1): action in ion channels and GPCRs
2011-01-01 Ioan, P; Carosati, E; Micucci, M; Cruciani, G; Broccatelli, F; Zhorov, B S; Chiarini, A; Budriesi, R
1,4-Dihydropyridine Scaffold in Medicinal Chemistry, The Story So Far And Perspectives (Part 2): Action in Other Targets and Antitargets
2012-01-01 Carosati, E.; Ioan, P.; Micucci, M.; Broccatelli, F.; Cruciani, G.; Zhorov, B. S.; Chiarini, A.; Budriesi, R.
A new class of selective myocardial calcium channel modulators. 2. Role of the acetal chain in oxadiazol-3-one derivatives
2005-01-01 Budriesi, Roberta; Carosati, Emanuele; Chiarini, Alberto; Cosimelli, Barbara; Cruciani, Gabriele; Ioan, Pierfranco; Spinelli, Domenico; Spisani, Raffaella
A novel approach for predicting P-glycoprotein (ABCB1) inhibition using molecular interaction fields
2011-01-01 Broccatelli, Fabio; Carosati, Emanuele; Neri, Annalisa; Frosini, Maria; Goracci, Laura; Oprea, Tudor I; Cruciani, Gabriele
ADME-Space: A new tool for medicinal chemists to explore ADME properties
2017-01-01 Bocci, G.; Carosati, E.; Vayer, P.; Arrault, A.; Lozano, S.; Cruciani, G.
Binding studies and GRIND/ALMOND-based 3D QSAR analysis of benzothiazine type K(ATP)-channel openers
2005-01-01 Carosati, Emanuele; Lemoine, Horst; Spogli, Roberto; Grittner, Dagmar; Mannhold, Raimund; Tabarrini, Oriana; Sabatini, Stefano; Cecchetti, Violetta
Calcium channel antagonists discovered by a multidisciplinary approach
2006-01-01 Carosati, Emanuele; Cruciani, Gabriele; Chiarini, Alberto; Budriesi, Roberta; Ioan, Pierfranco; Spisani, Raffaella; Spinelli, Domenico; Cosimelli, Barbara; Fusi, Fabio; Frosini, Maria; Matucci, Rosanna; Gasparrini, Francesco; Ciogli, Alessia; Stephens, Philip J; Devlin, Frank J
Combining machine learning and quantum mechanics yields more chemically aware molecular descriptors for medicinal chemistry applications
2021-01-01 Tortorella, S.; Carosati, E.; Sorbi, G.; Bocci, G.; Cross, S.; Cruciani, G.; Storchi, L.
Comparison of ligand-based and structure-based 3D-QSAR approaches: a case study on (aryl-)bridged 2-aminobenzonitriles inhibiting HIV-1 reverse transcriptase
2005-01-01 Sciabola, Simone; Carosati, Emanuele; Baroni, Massimo; Mannhold, Raimund
Destabilizers of the thymidylate synthase homodimer accelerate its proteasomal degradation and inhibit cancer growth
2022-01-01 Costantino, Luca; Ferrari, Stefania; Santucci, Matteo; Salo-Ahen, Outi M H; Carosati, Emanuele; Franchini, Silvia; Lauriola, Angela; Pozzi, Cecilia; Trande, Matteo; Gozzi, Gaia; Saxena, Puneet; Cannazza, Giuseppe; Losi, Lorena; Cardinale, Daniela; Venturelli, Alberto; Quotadamo, Antonio; Linciano, Pasquale; Tagliazucchi, Lorenzo; Moshella, Maria Gaetana; Guerrini, Remo; Pacifico, Salvatore; Luciani, Rosaria; Genovese, Filippo; Henrich, Stefan; Alboni, Silvia; Santarem, Nuno; da Silva Cordeiro, Anabela; Giovannetti, Elisa; Peters, Godefridus J; Pinton, Paolo; Rimessi, Alessandro; Cruciani, Gabriele; Stroud, Robert M; Wade, Rebecca C; Mangani, Stefano; Marverti, Gaetano; D'Arca, Domenico; Ponterini, Glauco; Paola Costi, Maria
Diltiazem analogues: the last ten years on structure activity relationships
2007-01-01 Budriesi, Roberta; Cosimelli, Barbara; Ioan, Pierfranco; Carosati, Emanuele; Ugenti, Maria P; Spisani, Rraffaella
Discovery of novel and cardioselective diltiazem-like calcium channel blockers via virtual screening
2008-01-01 Carosati, Emanuele; Budriesi, Roberta; Ioan, Pierfranco; Ugenti, Maria P; Frosini, Maria; Fusi, Fabio; Corda, Gaetano; Cosimelli, Barbara; Spinelli, Domenico; Chiarini, Alberto; Cruciani, Gabriele
Discovery of novel inhibitors of the NorA multidrug transporter of Staphylococcus aureus
2011-01-01 Brincat, Jean Pierre; Carosati, Emanuele; Sabatini, Stefano; Manfroni, Giuseppe; Fravolini, Arnaldo; Raygada, Jose L; Patel, Diixa; Kaatz, Glenn W; Cruciani, Gabriele
Discovery of Novel, Potent, and Specific Cell-Death Inducers in the Jurkat Acute Lymphoblastic Leukemia Cell Line
2015-01-01 Carosati, Emanuele; van den Höfel, Natascha; Reif, Manuela; Randazzo, Giuseppe Marco; Stanitzki, Bettina; Stevens, Julia; Gabbert, Helmut E; Cruciani, Gabriele; Mannhold, Raimund; Mahotka, Csaba
Exploring the chemical space around N-(5-nitrothiazol-2-yl)-1,2,3-thiadiazole-4-carboxamide, a hit compound with serine acetyltransferase (SAT) inhibitory properties
2022-01-01 Pavone, M.; Raboni, S.; Marchetti, M.; Annunziato, G.; Bettati, S.; Papotti, B.; Marchi, C.; Carosati, E.; Pieroni, M.; Campanini, B.; Costantino, G.
FLAP: GRID molecular interaction fields in virtual screening. validation using the DUD data set
2010-01-01 Cross, Simon; Baroni, Massimo; Carosati, Emanuele; Benedetti, Paolo; Clementi, Sergio
From 6-aminoquinolone antibacterials to 6-amino-7-thiopyranopyridinylquinolone ethyl esters as inhibitors of Staphylococcus aureus multidrug efflux pumps
2010-01-01 Pieroni, Marco; Dimovska, Mirjana; Brincat, Jean Pierre; Sabatini, Stefano; Carosati, Emanuele; Massari, Serena; Kaatz, Glenn W; Fravolini, Arnaldo
Homodimeric enzymes as drug targets
2010-01-01 Cardinale, D; Salo-Ahen, O M H; Ferrari, S; Ponterini, G; Cruciani, G; Carosati, E; Tochowicz, A M; Mangani, S; Wade, R C; Costi, M P
Hydrogen bonding interactions of covalently bonded fluorine atoms: from crystallographic data to a new angular function in the GRID force field
2004-01-01 Carosati, Emanuele; Sciabola, Simone; Cruciani, Gabriele
IAP antagonists: promising candidates for cancer therapy
2010-01-01 Mannhold, Raimund; Fulda, Simone; Carosati, Emanuele