Inhibition of the RNA-dependent RNA-polymerase from SARS-CoV-2 by 6-chloropurine isoxazoline-carbocyclic monophosphate nucleotides

التفاصيل البيبلوغرافية
العنوان:	Inhibition of the RNA-dependent RNA-polymerase from SARS-CoV-2 by 6-chloropurine isoxazoline-carbocyclic monophosphate nucleotides
المؤلفون:	Leusciatti, Marco, Macchi, Beatrice, Marino-Merlo, Francesca, Mastino, Antonio, Morra, Giulia, Quadrelli, Paolo
المساهمون:	Leusciatti, M, Macchi, B, Marino-Merlo, F, Mastino, A, Morra, G, Quadrelli, P
بيانات النشر:	AMER CHEMICAL SOC US
سنة النشر:	2023
المجموعة:	Universitá degli Studi di Roma "Tor Vergata": ART - Archivio Istituzionale della Ricerca
مصطلحات موضوعية:	Isoxazoline, RNA polymerase, SARS-COV-2, Docking, Settore CHIM/08 - Chimica Farmaceutica, Settore BIO/19, Settore CHIM/06
الوصف:	Isoxazoline-carbocyclic monophosphate nucleotides were designed and synthesized through the chemistry of nitrosocarbonyl intermediates and stable anthracenenitrile oxide. Docking and molecular dynamics studies were first conducted for determining the best candidate for polymerase SARS-CoV-2 inhibition. The setup phosphorylation protocol afforded the nucleotides available for the biological tests. Preliminary inhibition and cytotoxicity assays were then performed, and the results showed a moderate activity of the nucleotides accompanied by cytotoxicity.
نوع الوثيقة:	article in journal/newspaper
اللغة:	English
Relation:	info:eu-repo/semantics/altIdentifier/pmid/37810686; info:eu-repo/semantics/altIdentifier/wos/WOS:001072982800001; volume:8; issue:39; firstpage:36311; lastpage:36320; numberofpages:10; journal:ACS OMEGA; https://hdl.handle.net/2108/343383; info:eu-repo/semantics/altIdentifier/scopus/2-s2.0-85175024504
DOI:	10.1021/acsomega.3c04918
الاتاحة:	https://hdl.handle.net/2108/343383 https://doi.org/10.1021/acsomega.3c04918
Rights:	info:eu-repo/semantics/openAccess
رقم الانضمام:	edsbas.CB085FDF
قاعدة البيانات:	BASE

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الوصف
DOI:	10.1021/acsomega.3c04918