{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,6,10]],"date-time":"2026-06-10T14:13:53Z","timestamp":1781100833288,"version":"3.54.1"},"reference-count":26,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2021,5,1]],"date-time":"2021-05-01T00:00:00Z","timestamp":1619827200000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2021,5,1]],"date-time":"2021-05-01T00:00:00Z","timestamp":1619827200000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/legal\/tdmrep-license"},{"start":{"date-parts":[[2021,5,1]],"date-time":"2021-05-01T00:00:00Z","timestamp":1619827200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-017"},{"start":{"date-parts":[[2021,5,1]],"date-time":"2021-05-01T00:00:00Z","timestamp":1619827200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2021,5,1]],"date-time":"2021-05-01T00:00:00Z","timestamp":1619827200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-012"},{"start":{"date-parts":[[2021,5,1]],"date-time":"2021-05-01T00:00:00Z","timestamp":1619827200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2021,5,1]],"date-time":"2021-05-01T00:00:00Z","timestamp":1619827200000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-004"}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Bioorganic Chemistry"],"published-print":{"date-parts":[[2021,5]]},"DOI":"10.1016\/j.bioorg.2021.104772","type":"journal-article","created":{"date-parts":[[2021,2,23]],"date-time":"2021-02-23T22:58:15Z","timestamp":1614121095000},"page":"104772","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":51,"special_numbering":"C","title":["Molecular designing, crystal structure determination and in silico screening of copper(II) complexes bearing 8-hydroxyquinoline derivatives as anti-COVID-19"],"prefix":"10.1016","volume":"110","author":[{"given":"Arif","family":"Ali","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Nasim","family":"Sepay","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Mohd","family":"Afzal","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Nayim","family":"Sepay","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Abdullah","family":"Alarifi","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"M.","family":"Shahid","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Musheer","family":"Ahmad","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"78","reference":[{"key":"10.1016\/j.bioorg.2021.104772_b0005","doi-asserted-by":"crossref","unstructured":"Coronaviridae Study Group of the International Committee on Taxonomy of Viruses, The species Severe acute respiratory syndrome-related coronavirus: classifying 2019-nCoV and naming it SARS-CoV-2, Nat. Microbiol. 5 (2020) 536\u2013544. https:\/\/doi.org\/10.1038\/s41564-020-0695-z.","DOI":"10.1038\/s41564-020-0695-z"},{"key":"10.1016\/j.bioorg.2021.104772_b0010","doi-asserted-by":"crossref","first-page":"108427","DOI":"10.1016\/j.clim.2020.108427","article-title":"COVID-19 pathophysiology: a review","volume":"215","author":"Yuki","year":"2020","journal-title":"Clin. Immunol."},{"key":"10.1016\/j.bioorg.2021.104772_b0015","doi-asserted-by":"crossref","first-page":"58","DOI":"10.18433\/jpps31002","article-title":"Current drugs with potential for treatment of COVID-19: a literature review","volume":"23","author":"Rabby","year":"2020","journal-title":"J. Pharm. Pharm. Sci."},{"key":"10.1016\/j.bioorg.2021.104772_b0020","doi-asserted-by":"crossref","first-page":"471","DOI":"10.1186\/1475-2875-13-471","article-title":"Metal-chloroquine derivatives as possible anti-malarial drugs: evaluation of anti-malarial activity and mode of action","volume":"13","author":"Navarro","year":"2014","journal-title":"Malar. J."},{"key":"10.1016\/j.bioorg.2021.104772_b0025","doi-asserted-by":"crossref","first-page":"109815","DOI":"10.1016\/j.mehy.2020.109815","article-title":"Does zinc supplementation enhance the clinical efficacy of chloroquine\/hydroxychloroquine to win today\u2019s battle against COVID-19?","volume":"142","author":"Derwand","year":"2020","journal-title":"Med. Hypotheses"},{"key":"10.1016\/j.bioorg.2021.104772_b0030","doi-asserted-by":"crossref","first-page":"119267","DOI":"10.1016\/j.ica.2019.119267","article-title":"In situ reactivity of electrochemically generated nitro radical anion on Ornidazole and its monomeric Cu(II) complex with nucleic acid bases and calf thymus DNA","volume":"501","author":"Nandy","year":"2020","journal-title":"Inorg. Chim. Acta"},{"key":"10.1016\/j.bioorg.2021.104772_b0035","doi-asserted-by":"crossref","first-page":"4453","DOI":"10.1016\/j.bmcl.2013.05.041","article-title":"Structural and some medicinal characteristics of the copper(II)\u2013hydroxychloroquine complex","volume":"23","author":"Manning","year":"2013","journal-title":"Bioorg. Med. Chem. Lett."},{"key":"10.1016\/j.bioorg.2021.104772_b0040","doi-asserted-by":"crossref","first-page":"470","DOI":"10.1021\/jm7013259","article-title":"Novel copper(II) complex of N-Propyl-norfloxacin and 1,10-Phenanthroline with enhanced antileukemic and DNA nuclease activities","volume":"51","author":"Katsarou","year":"2008","journal-title":"J. Med. Chem."},{"key":"10.1016\/j.bioorg.2021.104772_b0045","doi-asserted-by":"crossref","first-page":"1862","DOI":"10.1016\/j.jinorgbio.2008.06.009","article-title":"Release studies from smart hydrogels as carriers for piroxicam and copper(II)\u2013oxicam complexes as anti-inflammatory and anti-cancer drugs. X-ray structures of new copper(II)\u2013piroxicam and \u2013isoxicam complex molecules","volume":"102","author":"Tamasi","year":"2008","journal-title":"J. Inorg. Biochem."},{"key":"10.1016\/j.bioorg.2021.104772_b0050","doi-asserted-by":"crossref","first-page":"611","DOI":"10.1007\/s10534-014-9736-5","article-title":"The many \u201cfaces\u201d of copper in medicine and treatment","volume":"27","author":"Hordyjewska","year":"2014","journal-title":"BioMetals"},{"key":"10.1016\/j.bioorg.2021.104772_b0055","doi-asserted-by":"crossref","first-page":"16342","DOI":"10.1021\/acsomega.9b04079","article-title":"Multitargeting antibacterial activity of a synthesized Mn2+ complex of curcumin on gram-positive and gram-negative bacterial strains","volume":"5","author":"Saha","year":"2020","journal-title":"ACS Omega"},{"key":"10.1016\/j.bioorg.2021.104772_b0060","doi-asserted-by":"crossref","first-page":"815","DOI":"10.1021\/cr400135x","article-title":"Advances in copper complexes as anticancer agents","volume":"114","author":"Santini","year":"2014","journal-title":"Chem. Rev."},{"key":"10.1016\/j.bioorg.2021.104772_b0065","doi-asserted-by":"crossref","first-page":"128732","DOI":"10.1016\/j.molstruc.2020.128732","article-title":"Spectroscopy driven DFT computation for a structure of the monomeric Cu2+-curcumin complex and thermodynamics driven evaluation of its binding to DNA: pseudo-binding of curcumin to DNA","volume":"1221","author":"Saha","year":"2020","journal-title":"J. Mol. Struct."},{"key":"10.1016\/j.bioorg.2021.104772_b0070","doi-asserted-by":"crossref","first-page":"1567","DOI":"10.21873\/invivo.11946","article-title":"COVID-19: the potential role of copper and N-acetylcysteine (NAC) in a combination of candidate antiviral treatments against SARS-CoV-2","volume":"34","author":"Andreou","year":"2020","journal-title":"Vivo (Brooklyn)"},{"key":"10.1016\/j.bioorg.2021.104772_b0075","doi-asserted-by":"crossref","first-page":"109814","DOI":"10.1016\/j.mehy.2020.109814","article-title":"Is copper beneficial for COVID-19 patients?","volume":"142","author":"Raha","year":"2020","journal-title":"Med. Hypotheses"},{"key":"10.1016\/j.bioorg.2021.104772_b0080","doi-asserted-by":"crossref","first-page":"e05278","DOI":"10.1016\/j.heliyon.2020.e05278","article-title":"Computer-aided drug design against spike glycoprotein of SARS-CoV-2 to aid COVID-19 treatment","volume":"6","author":"Shehroz","year":"2020","journal-title":"Heliyon"},{"key":"10.1016\/j.bioorg.2021.104772_b0085","doi-asserted-by":"crossref","first-page":"198022","DOI":"10.1016\/j.virusres.2020.198022","article-title":"COVID-19: CADD to the rescue","volume":"285","author":"Onawole","year":"2020","journal-title":"Virus Res."},{"key":"10.1016\/j.bioorg.2021.104772_b0090","doi-asserted-by":"crossref","first-page":"1686","DOI":"10.1007\/s12272-015-0640-5","article-title":"Role of computer-aided drug design in modern drug discovery","volume":"38","author":"Macalino","year":"2015","journal-title":"Arch. Pharm. Res."},{"key":"10.1016\/j.bioorg.2021.104772_b0095","doi-asserted-by":"crossref","first-page":"633","DOI":"10.3390\/md18120633","article-title":"A computer-aided drug design approach to predict marine drug-like leads for SARS-CoV-2 main protease inhibition","volume":"18","author":"Gaud\u00eancio","year":"2020","journal-title":"Mar. Drugs"},{"key":"10.1016\/j.bioorg.2021.104772_b0100","doi-asserted-by":"crossref","first-page":"104479","DOI":"10.1016\/j.bioorg.2020.104479","article-title":"Evaluation of catacholase mimicking activity and apoptosis in human colorectal carcinoma cell line by activating mitochondrial pathway of copper(II) complex coupled with 2-(quinolin-8-yloxy)(methyl)benzonitrile and 8-hydroxyquinoline","volume":"106","author":"Ali","year":"2021","journal-title":"Bioorg. Chem."},{"key":"10.1016\/j.bioorg.2021.104772_b0105","unstructured":"International Tables for X-Ray Crystallography, Vol. III, Kynoch Press, Birmingham, England, 1952, pp. 257\u2013269."},{"key":"10.1016\/j.bioorg.2021.104772_b0110","unstructured":"SAINT, version 6.02; Bruker AXS: Madison, WI, 1999."},{"key":"10.1016\/j.bioorg.2021.104772_b0115","unstructured":"G.M. Sheldrick, SADABS, Empirical Absorption Correction Program, University of G\u00f6ttingen, G\u00f6ttingen, Germany, 1997."},{"key":"10.1016\/j.bioorg.2021.104772_b0120","doi-asserted-by":"crossref","first-page":"339","DOI":"10.1107\/S0021889808042726","article-title":"OLEX2: a complete structure solution, refinement and analysis program","volume":"42","author":"Dolomanov","year":"2009","journal-title":"J. Appl. Crystallogr."},{"key":"10.1016\/j.bioorg.2021.104772_b0125","doi-asserted-by":"crossref","first-page":"59","DOI":"10.1107\/S2053273314022207","article-title":"The anatomy of a comprehensive constrained, restrained refinement program for the modern computing environment \u2013 Olex2 dissected","volume":"71","author":"Bourhis","year":"2015","journal-title":"Acta Crystallogr. Sect. A Found. Adv."},{"key":"10.1016\/j.bioorg.2021.104772_b0130","doi-asserted-by":"crossref","first-page":"946","DOI":"10.1021\/ar300024d","article-title":"Carbohydrate-aromatic interactions","volume":"46","author":"Asensio","year":"2013","journal-title":"Acc. Chem. Res."}],"container-title":["Bioorganic Chemistry"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0045206821001498?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0045206821001498?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2025,9,23]],"date-time":"2025-09-23T08:11:48Z","timestamp":1758615108000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S0045206821001498"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2021,5]]},"references-count":26,"alternative-id":["S0045206821001498"],"URL":"https:\/\/doi.org\/10.1016\/j.bioorg.2021.104772","relation":{},"ISSN":["0045-2068"],"issn-type":[{"value":"0045-2068","type":"print"}],"subject":[],"published":{"date-parts":[[2021,5]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"Molecular designing, crystal structure determination and in silico screening of copper(II) complexes bearing 8-hydroxyquinoline derivatives as anti-COVID-19","name":"articletitle","label":"Article Title"},{"value":"Bioorganic Chemistry","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.bioorg.2021.104772","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2021 Elsevier Inc. All rights reserved.","name":"copyright","label":"Copyright"}],"article-number":"104772"}}