Molecular Modelling Studies To Suggest Novel Scaffolds Against Sars-Cov Target Enzymes

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dc.authoridSahin, Ahmet Fatih/0000-0001-7802-8730
dc.authorwosidŞAHİN, Abdullah Fahri/JUU-2457-2023
dc.authorwosidAkdemir, Atilla/G-2595-2015
dc.authorwosidKüçükgüzel, Ş.Güniz/AAQ-8954-2021
dc.contributor.authorKüçükgüzel, Şükriye Güniz
dc.contributor.authorKucukguzel, S. Guniz
dc.contributor.authorAkdemir, Atilla
dc.contributor.otherEczacılık Meslek Bilimleri Bölümü
dc.date.accessioned2025-01-11T13:01:38Z
dc.date.available2025-01-11T13:01:38Z
dc.date.issued2021
dc.departmentFenerbahçe Universityen_US
dc.department-temp[Sahin, Ahmet Fatih; Akdemir, Atilla] Bezmialem Vakif Univ, Inst Hlth Sci, Dept Drug Discovery & Dev, TR-34093 Istanbul, Turkey; [Kucukguzel, S. Guniz] Fenerbahce Univ, Vocat Sch Hlth Serv, TR-34093 Istanbul, Turkey; [Akdemir, Atilla] Bezmialem Vakif Univ, Fac Pharm, Dept Pharmacol, Comp Aided Drug Discovery Lab, TR-34093 Istanbul, Turkeyen_US
dc.descriptionSahin, Ahmet Fatih/0000-0001-7802-8730en_US
dc.description.abstractIn this study, molecular modelling study of previously synthesized compounds against SARS-CoV-2 target enzyme was performed. A subset of 156 compounds from an in-house database has been subjected to molecular modelling studies against the SARS-CoV-2 ADP-ribose phosphatase (ADRP, NSP3), Papain-like protease (PLpro), and uridine specific endoribonuclease (NSP15) enzymes. We have identified one compound that is expected to inhibit the SARS-CoV-2 ADRP enzyme and one compound that is expected to inhibit the NSP15 enzyme.en_US
dc.description.woscitationindexEmerging Sources Citation Index
dc.identifier.citation1
dc.identifier.doi10.29228/jrp.96
dc.identifier.endpage1017en_US
dc.identifier.issn2630-6344
dc.identifier.issue6en_US
dc.identifier.scopusqualityQ4
dc.identifier.startpage1010en_US
dc.identifier.trdizinid488949
dc.identifier.urihttps://doi.org/10.29228/jrp.96
dc.identifier.urihttps://hdl.handle.net/20.500.14627/160
dc.identifier.volume25en_US
dc.identifier.wosWOS:000725063300028
dc.language.isoenen_US
dc.publisherMarmara Univen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/openAccessen_US
dc.subjectSars-Cov-2en_US
dc.subjectCovid-19en_US
dc.subjectAdrpen_US
dc.subjectPlproen_US
dc.subjectNsp15en_US
dc.subjectDockingen_US
dc.subjectMolecular Dynamicsen_US
dc.titleMolecular Modelling Studies To Suggest Novel Scaffolds Against Sars-Cov Target Enzymesen_US
dc.typeArticleen_US
dspace.entity.typePublication
relation.isAuthorOfPublicationccdbdc32-5572-44d5-8ee3-7caed45f6422
relation.isAuthorOfPublication.latestForDiscoveryccdbdc32-5572-44d5-8ee3-7caed45f6422
relation.isOrgUnitOfPublication5052e089-e75d-4aec-a280-6353973e4819
relation.isOrgUnitOfPublication.latestForDiscovery5052e089-e75d-4aec-a280-6353973e4819

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