Molecular Modelling Studies To Suggest Novel Scaffolds Against Sars-Cov Target Enzymes
| dc.authorid | Sahin, Ahmet Fatih/0000-0001-7802-8730 | |
| dc.authorscopusid | 57410184700 | |
| dc.authorscopusid | 55894906300 | |
| dc.authorscopusid | 8912960500 | |
| dc.authorwosid | ŞAHİN, Abdullah Fahri/JUU-2457-2023 | |
| dc.authorwosid | Akdemir, Atilla/G-2595-2015 | |
| dc.authorwosid | Küçükgüzel, Ş.Güniz/AAQ-8954-2021 | |
| dc.contributor.author | Şahin, A.F. | |
| dc.contributor.author | Küçükgüzel, Şükriye Güniz | |
| dc.contributor.author | Küçükgüzel, Ş.G. | |
| dc.contributor.author | Akdemir, A. | |
| dc.contributor.other | Eczacılık Meslek Bilimleri Bölümü | |
| dc.date.accessioned | 2025-01-11T13:01:38Z | |
| dc.date.available | 2025-01-11T13:01:38Z | |
| dc.date.issued | 2021 | |
| dc.department | Fenerbahçe University | en_US |
| dc.department-temp | Şahin A.F., Department of Drug Discovery and Development, Institute of Health Sciences, Bezmialem Vakif University, Fatih, İstanbul, 34093, Turkey; Küçükgüzel Ş.G., Vocational School of Health Services, Fenerbahçe University, Ataşehir, Istanbul, 34758, Turkey; Akdemir A., Department of Drug Discovery and Development, Institute of Health Sciences, Bezmialem Vakif University, Fatih, İstanbul, 34093, Turkey, Computer-aided Drug Discovery Laboratory, Department of Pharmacology, Faculty of Pharmacy, Bezmialem Vakif University, Istanbul, 34093, Turkey | en_US |
| dc.description.abstract | In 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. © 2021 Marmara University Press ISSN: 2630-6344. | en_US |
| dc.description.woscitationindex | Emerging Sources Citation Index | |
| dc.identifier.citation | 1 | |
| dc.identifier.doi | 10.29228/jrp.96 | |
| dc.identifier.endpage | 1017 | en_US |
| dc.identifier.issn | 2630-6344 | |
| dc.identifier.issue | 6 | en_US |
| dc.identifier.scopus | 2-s2.0-85122758556 | |
| dc.identifier.scopusquality | Q4 | |
| dc.identifier.startpage | 1010 | en_US |
| dc.identifier.trdizinid | 488949 | |
| dc.identifier.uri | https://doi.org/10.29228/jrp.96 | |
| dc.identifier.volume | 25 | en_US |
| dc.identifier.wos | WOS:000725063300028 | |
| dc.identifier.wosquality | N/A | |
| dc.language.iso | en | en_US |
| dc.publisher | Marmara University | en_US |
| dc.relation.ispartof | Journal of Research in Pharmacy | en_US |
| dc.relation.publicationcategory | Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı | en_US |
| dc.rights | info:eu-repo/semantics/openAccess | en_US |
| dc.scopus.citedbyCount | 1 | |
| dc.subject | Adrp | en_US |
| dc.subject | Covid-19 | en_US |
| dc.subject | Docking | en_US |
| dc.subject | Molecular Dynamics | en_US |
| dc.subject | Nsp15 | en_US |
| dc.subject | PlPro | en_US |
| dc.subject | Sars-Cov-2 | en_US |
| dc.title | Molecular Modelling Studies To Suggest Novel Scaffolds Against Sars-Cov Target Enzymes | en_US |
| dc.type | Article | en_US |
| dc.wos.citedbyCount | 1 | |
| dspace.entity.type | Publication | |
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