{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,9,20]],"date-time":"2026-09-20T16:27:46Z","timestamp":1789921666716,"version":"4.0.1"},"reference-count":0,"publisher":"Bentham Science Publishers Ltd.","issue":"3","funder":[{"DOI":"10.13039\/501100004681","name":"Higher Education Commission, Pakistan","doi-asserted-by":"publisher","award":["21-1919\/SRGP\/ R&D\/HEC\/2018"],"award-info":[{"award-number":["21-1919\/SRGP\/ R&D\/HEC\/2018"]}],"id":[{"id":"10.13039\/501100004681","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["eurekaselect.com"],"crossmark-restriction":true},"short-container-title":["CAD"],"published-print":{"date-parts":[[2020,6,2]]},"abstract":"<jats:sec>\n<jats:title>Background:<\/jats:title>\n<jats:p>Insulin-dependent Diabetes Mellitus Type 1 (T1D) also referred to as autoimmune\ndiabetes. T1D is a chronic disease which is characterized by way of insulin deficiency.\nThe deficiency is due to the loss of pancreatic \u03b2 cells and leads to hyperglycemia. There are many\nfactors which play a significant role in T1D disease pathogenicity including genetic predisposition,\nthe immune system, and environmental factors. The environmental factors may include Coxsackie\nB4 virus, a small RNA virus.<\/jats:p>\n<\/jats:sec>\n<jats:sec>\n<jats:title>Objective:<\/jats:title>\n<jats:p>The objective of current in silico study is to identify active lead compounds against Coxsackie\nB4 virus, a small RNA virus which has been reported in diabetic patients after PCR. There is\na need to predict inhibitors against TID caused by Coxsackie B4 viral protein that may be used as a\ndrug against TID in the future.<\/jats:p>\n<\/jats:sec>\n<jats:sec>\n<jats:title>Methods:<\/jats:title>\n<jats:p> For this purpose, different bioinformatics databases and tools were used. The protein\nstructure generation and validation, retrieval of ligands and their properties analysis were performed\nby different databases, web servers, and software tools. Moreover, the docking tools were\nused to identify the target site of the protein and interaction of different inhibitors with the target\nprotein molecule.<\/jats:p>\n<\/jats:sec>\n<jats:sec>\n<jats:title>Results:<\/jats:title>\n<jats:p>Based on the analysis, two lead compounds ZINC00034488 and ZINC00034585 were selected\nas potential drugs. These compounds are non-toxic and have best interaction energy and fulfill\nLipinski rule, Veber rule, Ghose Rule, Weighted QED, Unweighted QED and BBB likeness parameters.<\/jats:p>\n<\/jats:sec>\n<jats:sec>\n<jats:title>Conclusion:<\/jats:title>\n<jats:p>Our work will help researchers to get an idea about the understanding of chemicals\nagainst Coxsackie B4 Viruses and helpful to design a drug and test these chemicals to overcome\nDiabetes Mellitus Type 1 caused by Coxsackie B4 virus.<\/jats:p>\n<\/jats:sec>","DOI":"10.2174\/1573409915666190820154422","type":"journal-article","created":{"date-parts":[[2019,8,20]],"date-time":"2019-08-20T14:55:41Z","timestamp":1566312941000},"page":"318-326","update-policy":"https:\/\/doi.org\/10.2174\/bsp_crossmark_policy","source":"Crossref","is-referenced-by-count":4,"title":["Inhibition of 2C Coxsackie B Virus Protein to Decrease Pathogenicity of Diabetes Mellitus Type 1"],"prefix":"10.2174","volume":"16","author":[{"given":"Amina","family":"Amin","sequence":"first","affiliation":[{"name":"Department of Biosciences, COMSATS University Islamabad, Sahiwal Campus, Sahiwal, Pakistan"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-9886-1591","authenticated-orcid":true,"given":"Muhammad A.","family":"Rasheed","sequence":"additional","affiliation":[{"name":"Department of Biosciences, COMSATS University Islamabad, Sahiwal Campus, Sahiwal, Pakistan"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Rana A.","family":"Diwan","sequence":"additional","affiliation":[{"name":"Department of Community Medicine, Sahiwal Medical College, Sahiwal, Pakistan"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Muhammad","family":"Shahid","sequence":"additional","affiliation":[{"name":"Government Mian Meer THQ Hospital, Lahore, Pakistan"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Saddia","family":"Bano","sequence":"additional","affiliation":[{"name":"Research Center for Modeling and Simulations, National University of Sciences and Technology, Islamabad, Pakistan"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Adnan","family":"Riaz","sequence":"additional","affiliation":[{"name":"School of Computer Science and Technology, Dalian University of Technology, Dalian, China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Muhammad N.","family":"Iqbal","sequence":"additional","affiliation":[{"name":"Department of Biosciences, COMSATS University Islamabad, Sahiwal Campus, Sahiwal, Pakistan"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Muhammad W.","family":"Sajid","sequence":"additional","affiliation":[{"name":"Department of Biosciences, COMSATS University Islamabad, Sahiwal Campus, Sahiwal, Pakistan"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"965","container-title":["Current Computer-Aided Drug Design"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/eurekaselect.com\/article\/download\/174352","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2020,7,17]],"date-time":"2020-07-17T03:49:55Z","timestamp":1594957795000},"score":1,"resource":{"primary":{"URL":"https:\/\/www.eurekaselect.com\/174352\/article"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2020,6,2]]},"references-count":0,"journal-issue":{"issue":"3","published-print":{"date-parts":[[2020,6,2]]}},"alternative-id":["LiveAll1"],"URL":"https:\/\/doi.org\/10.2174\/1573409915666190820154422","relation":{},"ISSN":["1573-4099"],"issn-type":[{"value":"1573-4099","type":"print"}],"subject":[],"published":{"date-parts":[[2020,6,2]]},"assertion":[{"value":"Peer Reviewed","order":0,"name":"review_status","label":"Review Status","group":{"name":"peer_review_details","label":"Peer Review Details"}},{"value":"Single blind","order":1,"name":"review_process","label":"Review Process","group":{"name":"peer_review_details","label":"Peer Review Details"}},{"value":"Checked with iThenticate","order":0,"name":"screening_status","label":"Screening Status","group":{"name":"plagiarism_screening","label":"Plagiarism Screening"}},{"value":"2019-03-08","order":0,"name":"received","label":"Received","group":{"name":"publication_history","label":"Publication History"}},{"value":"2019-06-27","order":1,"name":"revised","label":"Revised","group":{"name":"publication_history","label":"Publication History"}},{"value":"2019-08-01","order":2,"name":"accepted","label":"Accepted","group":{"name":"publication_history","label":"Publication History"}},{"value":"2020-06-02","order":3,"name":"published","label":"Published","group":{"name":"publication_history","label":"Publication History"}}]}}