dc.creator | Senćanski, Milan | |
dc.creator | Perović, Vladimir | |
dc.creator | Milićević, Jelena S. | |
dc.creator | Todorović, Tamara | |
dc.creator | Prodanović, Radivoje | |
dc.creator | Veljković, Veljko | |
dc.creator | Paessler, Slobodan | |
dc.creator | Glišić, Sanja | |
dc.date.accessioned | 2022-10-03T09:50:54Z | |
dc.date.available | 2022-10-03T09:50:54Z | |
dc.date.issued | 2022 | |
dc.identifier.issn | 2191-1363 | |
dc.identifier.uri | https://vinar.vin.bg.ac.rs/handle/123456789/10425 | |
dc.description.abstract | In the currentpandemic,findingan effectivedrugto preventortreatthe infectionis the highestpriority.A rapidand safeapproachto counteractCOVID-19is in silicodrugrepurposing.The SARS-CoV-2PLpropromotesviral replicationand modu-latesthe hostimmunesystem,resultingin inhibitionof thehostantiviralinnateimmuneresponse,and thereforeis anattractivedrugtarget.In this study,we useda combinedinsilicovirtualscreeningfor candidatesfor SARS-CoV-2PLproproteaseinhibitors.We usedthe Informationalspectrummethodappliedfor SmallMoleculesfor searchingthe Drugbankdatabasefollowedby moleculardocking.Afterin silicoscreen-ing of drugspace,we identified44 drugsas potentialSARS-CoV-2PLproinhibitorsthat we proposefor furtherexperimentaltesting. | en |
dc.language.iso | en | en |
dc.relation | info:eu-repo/grantAgreement/ScienceFundRS/Fond_2020_COVID19/7551100/RS// | |
dc.rights | openAccess | |
dc.rights.uri | https://creativecommons.org/licenses/by-nc-nd/4.0/ | |
dc.source | ChemistryOpen | sr |
dc.subject | drug repurposing | en |
dc.subject | ISM | en |
dc.subject | molecular docking | en |
dc.subject | Papain-like protease | en |
dc.subject | SARS-CoV-2 | en |
dc.title | Identification of SARS-CoV-2 Papain-like Protease (PLpro) Inhibitors Using Combined Computational Approach | en |
dc.type | article | |
dc.rights.license | BY-NC-ND | |
dc.citation.volume | 11 | |
dc.citation.issue | 2 | |
dc.citation.spage | e202100248 | |
dc.identifier.wos | 000760306500002 | |
dc.identifier.doi | 10.1002/open.202100248 | |
dc.type.version | publishedVersion | sr |
dc.identifier.scopus | 2-s2.0-85124056675 | |
dc.identifier.fulltext | http://vinar.vin.bg.ac.rs/bitstream/id/26953/Identification_of_SARS.pdf | |