Synthesis and Characterization of Oxime Derivatives and their Some Transition Metal Complexes with Thiadiazole Groups: Biological Activities, and Molecular Docking Studies of the Ligands

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dc.authoridUYSAL, Saban/0000-0003-1061-6143
dc.contributor.authorOtaiwi, Ahmed Saleem
dc.contributor.authorMirghani, Ahmed Hamdi
dc.contributor.authorBostanci, Hayrani Eren
dc.contributor.authorCoskun, Ahmet
dc.contributor.authorTahtaci, Hakan
dc.contributor.authorUysal, Saban
dc.date.accessioned2024-09-29T15:50:51Z
dc.date.available2024-09-29T15:50:51Z
dc.date.issued2024
dc.departmentKarabük Üniversitesien_US
dc.description.abstractThis study involved the synthesis and investigation of the anticancer and antioxidant capabilities of six newly developed ligands generated from 1,3,4-thiadiazole and diphenyl ether keto oxime which has never been synthesized before, together with their transition metal complexes. The obtained ligands were characterized using elemental analysis, FTIR, 1H NMR, 13C NMR, and mass spectroscopy. Polymeric complexes of the obtained ligands were synthesized by reacting all ligands with MCl2.nH2O (M: Mn2+/Co2+)/Ni2+/Cu2+)) salts. The polymeric complexes ' structures were determined using elemental analysis, ICP-AES, FTIR spectroscopy, UV-vis spectroscopy, magnetic susceptibility analysis, and thermogravimetric analysis. Subsequently, the ligands were examined for their anticancer properties. To achieve this objective, the HT-22 cell line, which consists of healthy mouse hippocampus neuronal cells, is utilized as the control group. Additionally, the MCF7 (breast cancer), MDA-MB-231 (breast cancer), C6 (rat glioma), HT-29 (colon cancer), and A549 (lung carcinoma) cell lines are employed in cell culture research as representatives of cancerous cell lines. Based on the cell culture investigations, some of the synthesized ligands showed moderate to good anti-cancer activity, especially for both colon cancer and brain tumors. Finally, a molecular docking analysis was conducted utilizing MOE software to ascertain the binding affinity between the synthesized ligands and the specific proteins of interest. This study includes the synthesis of transition metal complexes of six new ligands obtained from 1,3,4-thiadiazole and diphenyl ether keto oxime and the investigation of the anticancer and antioxidant properties of the ligands. Finally, a molecular docking analysis was performed to determine the binding affinity between the synthesized ligands and specific proteins of interest. imageen_US
dc.description.sponsorshipKarabuk University [KBUBAP-22-YL-121]; Karabuk University Scientific Research Projects Coordinatorshipen_US
dc.description.sponsorshipWe acknowledge that this study was financially supported by the Karabuk University Scientific Research Projects Coordinatorship (Project No: KBUBAP-22-YL-121).en_US
dc.identifier.doi10.1002/slct.202400863
dc.identifier.issn2365-6549
dc.identifier.issue16en_US
dc.identifier.scopus2-s2.0-85191101383en_US
dc.identifier.scopusqualityQ2en_US
dc.identifier.urihttps://doi.org/10.1002/slct.202400863
dc.identifier.urihttps://hdl.handle.net/20.500.14619/3752
dc.identifier.volume9en_US
dc.identifier.wosWOS:001206049100001en_US
dc.identifier.wosqualityN/Aen_US
dc.indekslendigikaynakWeb of Scienceen_US
dc.indekslendigikaynakScopusen_US
dc.language.isoenen_US
dc.publisherWiley-V C H Verlag Gmbhen_US
dc.relation.ispartofChemistryselecten_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectOximeen_US
dc.subject1,3,4-Thiadiazoleen_US
dc.subjectTransition Metal Complexen_US
dc.subjectAnticancer activityen_US
dc.subjectAntioxidant activityen_US
dc.titleSynthesis and Characterization of Oxime Derivatives and their Some Transition Metal Complexes with Thiadiazole Groups: Biological Activities, and Molecular Docking Studies of the Ligandsen_US
dc.typeArticleen_US

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