Bovine Serum Amine Oxidase and Polyamine Analogues: Chemical Synthesis and Biological Evaluation Integrated with Molecular Docking and 3-D QSAR Studies.

Antineoplastic Agents / pharmacology Ligands Molecular Docking Simulation Monoamine Oxidase / metabolism Polyamines / metabolism Quantitative Structure-Activity Relationship Spermine / pharmacology

Journal

Journal of chemical information and modeling
ISSN: 1549-960X
Titre abrégé: J Chem Inf Model
Pays: United States
ID NLM: 101230060

Informations de publication

Date de publication:
22 08 2022
Historique:
pubmed: 11 8 2022
medline: 24 8 2022
entrez: 10 8 2022
Statut: ppublish

Résumé

Natural polyamines (PAs) are key players in cellular homeostasis by regulating cell growth and proliferation. Several observations highlight that PAs are also implicated in pathways regulating cell death. Indeed, the PA accumulation cytotoxic effect, maximized with the use of bovine serum amine oxidase (BSAO) enzyme, represents a valuable strategy against tumor progression. In the present study, along with the design, synthesis, and biological evaluation of a series of new spermine (Spm) analogues (

Identifiants

DOI: 10.1021/acs.jcim.2c00559 PMID: 35948439
pubmed: 35948439
doi: 10.1021/acs.jcim.2c00559
doi:

Substances chimiques

Antineoplastic Agents 0
Ligands 0
Polyamines 0
Spermine 2FZ7Y3VOQX
Monoamine Oxidase EC 1.4.3.4

Types de publication

Journal Article Research Support, Non-U.S. Gov't

Langues

eng

Sous-ensembles de citation

IM

Pagination

3910-3927

Auteurs

Rino Ragno (R)

Rome Center for Molecular Design, Department of Drug Chemistry and Technology, Sapienza Università di Roma, P. le A. Moro 5, Roma 00185, Italy.
ORCID: 0000-0001-5399-975X

Anna Minarini (A)

Department of Pharmacy and Biotechnology, Alma Mater Studiorum-University of Bologna, Via Belmeloro 6, Bologna 40126, Italy.

Eleonora Proia (E)

Rome Center for Molecular Design, Department of Drug Chemistry and Technology, Sapienza Università di Roma, P. le A. Moro 5, Roma 00185, Italy.

Antonini Lorenzo (A)

Rome Center for Molecular Design, Department of Drug Chemistry and Technology, Sapienza Università di Roma, P. le A. Moro 5, Roma 00185, Italy.

Andrea Milelli (A)

Department for Life Quality Studies, Alma Mater Studiorum-University of Bologna, Corso d'Augusto, 237, Rimini 47921, Italy.
ORCID: 0000-0003-2285-7403

Vincenzo Tumiatti (V)

Department for Life Quality Studies, Alma Mater Studiorum-University of Bologna, Corso d'Augusto, 237, Rimini 47921, Italy.

Marco Fiore (M)

Department Institute of Biochemistry and Cell Biology, IBBC-CNR, Via E. Ramarini, 32, Monterotondo Scalo Rome 00015, Italy.

Pasquale Fino (P)

UOC of Dermatology, Policlinico Umberto I Hospital, Sapienza Medical School of Rome, Viale del Policlinico 155, Rome I-00161, Italy.

Lavinia Rutigliano (L)

Department of Sensory Organs, Sapienza University of Rome, Policlinico Umberto I, Viale del Policlinico155, Rome I-00161, Italy.

Rossella Fioravanti (R)

Department of Drug Chemistry and Technology, Sapienza Università di Roma, P. le A. Moro 5, Roma 00185, Italy.

Tomoaki Tahara (T)

Department of Sensory Organs, Sapienza University of Rome, Policlinico Umberto I, Viale del Policlinico155, Rome I-00161, Italy.

Elena Pacella (E)

Department of Sensory Organs, Sapienza University of Rome, Policlinico Umberto I, Viale del Policlinico155, Rome I-00161, Italy.

Antonio Greco (A)

Department of Sensory Organs, Sapienza University of Rome, Policlinico Umberto I, Viale del Policlinico155, Rome I-00161, Italy.

Gianluca Canettieri (G)

Department of Molecular Medicine, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy.
Istituto Pasteur, Fondazione Cenci-Bolognetti, Sapienza University of Rome, Viale Regina Elena 291, Rome 00161, Italy.

Maria Luisa Di Paolo (ML)

Department of Molecular Medicine, University Padua, Via G. Colombo 3, Padova 35131, Italy.

Enzo Agostinelli (E)

Department of Sensory Organs, Sapienza University of Rome, Policlinico Umberto I, Viale del Policlinico155, Rome I-00161, Italy.
International Polyamines Foundation 'ETS-ONLUS', Via del Forte Tiburtino 98, Rome I-00159, Italy.
ORCID: 0000-0002-2508-8868

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Classifications MeSH

questionsmedicales.fr › Actions chimiques et utilisations › Actions pharmacologiques › Utilisations thérapeutiques › Antinéoplasiques › Bovine Serum Amine Oxidase and Polyamine...
questionsmedicales.fr › Actions chimiques et utilisations › Utilisations spécialisées de produits chimiques › Produits chimiques de laboratoire › Ligands › Bovine Serum Amine Oxidase and Polyamine...
questionsmedicales.fr › Sciences de l'information › Méthodologies informatiques › Simulation numérique › Simulation de docking moléculaire › Bovine Serum Amine Oxidase and Polyamine...
questionsmedicales.fr › Enzymes et coenzymes › Enzymes › Oxidoreductases › Oxidoreductases acting on CH-NH2 group donors › Monoamine oxidase › Bovine Serum Amine Oxidase and Polyamine...
questionsmedicales.fr › Composés chimiques organiques › Amines › Polyamines › Bovine Serum Amine Oxidase and Polyamine...
questionsmedicales.fr › Phénomènes physiologiques › Phénomènes pharmacologiques et toxicologiques › Phénomènes pharmacologiques › Relation structure-activité › Relation quantitative structure-activité › Bovine Serum Amine Oxidase and Polyamine...
questionsmedicales.fr › Composés chimiques organiques › Amines › Polyamines › Spermine › Bovine Serum Amine Oxidase and Polyamine...