Assessment of Anticholinergic and Antidiabetic Properties of Some Natural and Synthetic Molecules: An In Vitro and In Silico Approach

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dc.authoridKUZU, Muslum/0000-0002-1375-7673
dc.authoridGulcin, ilhami/0000-0001-5993-1668
dc.authoridAdem, Sevki/0000-0003-2146-5870
dc.authoridAkincioglu, Hulya/0000-0001-5453-0953
dc.authoridaygul, imdat/0000-0002-7811-1726
dc.contributor.authorComakli, Veysel
dc.contributor.authorAygul, Imdat
dc.contributor.authorSaglamtas, Ruya
dc.contributor.authorKuzu, Muslum
dc.contributor.authorDemirdag, Ramazan
dc.contributor.authorAkincioglu, Hulya
dc.contributor.authorAdem, Sevki
dc.date.accessioned2024-09-29T16:06:42Z
dc.date.available2024-09-29T16:06:42Z
dc.date.issued2024
dc.departmentKarabük Üniversitesien_US
dc.description.abstractIntroduction: This study aimed to determine the in vitro and in silico effects of some natural and synthetic molecules on acetylcholinesterase (AChE), butyrylcholinesterase (BChE) and alpha-glucosidase enzymes. Background: Alzheimer's disease (AD) and Type II diabetes mellitus (T2DM) are considered the most important diseases of today's world. However, the side effects of therapeutic agents used in both diseases limit their use. Therefore, developing drugs with high therapeutic efficacy and better pharmacological profile is important. Objectives: This study sets out to determine the related enzyme inhibitors used in treating AD and T2DM, considered amongst the most important diseases of today's world. Methods: In the current study, the in vitro and in silico effects of dienestrol, hesperetin, L-thyroxine, 3,3',5-Triiodo-L-thyronine (T3) and dobutamine molecules on AChE, BChE and alpha-glycosidase enzyme activities were investigated. Results: All the molecules showed an inhibitory effect on the enzymes. The IC50 and Ki values of the L-Thyroxine molecule, which showed the strongest inhibition effect for the AChE enzyme, were determined as 1.71 mu M and 0.83 +/- 0.195 mu M, respectively. In addition, dienestrol, T3, and dobutamine molecules showed a more substantial inhibition effect than tacrine. The dobutamine molecule showed the most substantial inhibition effect for the BChE enzyme, and IC50 and Ki values were determined as 1.83 mu M and 0.845 +/- 0.143 mu M, respectively. The IC50 and Ki values for the hesperetin molecule, which showed the strongest inhibition for the alpha-glycosidase enzyme, were determined as 13.57 mu M and 12.33 +/- 2.57 mu M, respectively. Conclusion: According to the results obtained, the molecules used in the study may be considered potential inhibitor candidates for AChE, BChE and alpha-glycosidase.en_US
dc.identifier.doi10.2174/1573409919666230518151414
dc.identifier.endpage451en_US
dc.identifier.issn1573-4099
dc.identifier.issn1875-6697
dc.identifier.issue5en_US
dc.identifier.pmid37202895en_US
dc.identifier.scopus2-s2.0-85188289755en_US
dc.identifier.scopusqualityQ3en_US
dc.identifier.startpage441en_US
dc.identifier.urihttps://doi.org/10.2174/1573409919666230518151414
dc.identifier.urihttps://hdl.handle.net/20.500.14619/6994
dc.identifier.volume20en_US
dc.identifier.wosWOS:001208305200002en_US
dc.identifier.wosqualityN/Aen_US
dc.indekslendigikaynakWeb of Scienceen_US
dc.indekslendigikaynakScopusen_US
dc.indekslendigikaynakPubMeden_US
dc.language.isoenen_US
dc.publisherBentham Science Publ Ltden_US
dc.relation.ispartofCurrent Computer-Aided Drug Designen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectMolecular modellingen_US
dc.subjectinhibitionen_US
dc.subjectAlzheimer's diseaseen_US
dc.subjecttype II diabetes mellitusen_US
dc.subjectacetylcholinesteraseen_US
dc.subjectbutyrylcholinesteraseen_US
dc.subjectalpha-glycosidaseen_US
dc.titleAssessment of Anticholinergic and Antidiabetic Properties of Some Natural and Synthetic Molecules: An In Vitro and In Silico Approachen_US
dc.typeArticleen_US

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