{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,9,30]],"date-time":"2026-09-30T09:56:10Z","timestamp":1790762170979,"version":"4.1.0"},"reference-count":53,"publisher":"Wiley","issue":"3","license":[{"start":{"date-parts":[[2026,9,19]],"date-time":"2026-09-19T00:00:00Z","timestamp":1789776000000},"content-version":"vor","delay-in-days":18,"URL":"http:\/\/creativecommons.org\/licenses\/by\/4.0\/"},{"start":{"date-parts":[[2026,9,1]],"date-time":"2026-09-01T00:00:00Z","timestamp":1788220800000},"content-version":"tdm","delay-in-days":0,"URL":"http:\/\/doi.wiley.com\/10.1002\/tdm_license_1.1"}],"content-domain":{"domain":["onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["Chem Biol Drug Des"],"published-print":{"date-parts":[[2026,9]]},"abstract":"<jats:title>ABSTRACT<\/jats:title>\n                  <jats:p>\n                    A series of novel benzisothiazole\u2010based hydrazide derivatives was rationally designed, synthesized, and evaluated for their antitubercular activity. Among the synthesized compounds, derivative\n                    <jats:bold>8k<\/jats:bold>\n                    emerged as the most potent candidate, exhibiting a minimum inhibitory concentration (MIC) of 0.25\u2009\u03bcg\/mL, along with a high selectivity index (SI) of 42 and confirmed bactericidal activity. To gain preliminary insights into its possible mechanism of action, compound\n                    <jats:bold>8k<\/jats:bold>\n                    was subjected to molecular docking and 100\u2009ns molecular dynamics simulations, using enoyl\u2010acyl carrier protein reductase (InhA) as the proposed molecular target. The computational studies revealed favorable binding interactions and a relatively stable protein\u2013ligand complex, suggesting InhA as a potential molecular target. However, experimental target\u2010validation studies are required to confirm direct InhA inhibition and establish the proposed mechanism of action. Furthermore, in silico ADMET predictions indicated favorable pharmacokinetic characteristics and drug\u2010likeness properties for the lead compound. Collectively, these findings highlight the potential of benzisothiazole\u2010based hydrazide derivatives as promising scaffolds for the development of new antitubercular agents.\n                  <\/jats:p>","DOI":"10.1111\/cbdd.70405","type":"journal-article","created":{"date-parts":[[2026,9,19]],"date-time":"2026-09-19T07:15:56Z","timestamp":1789802156000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":0,"title":["Design, Synthesis, Antimycobacterial Evaluation, and In Silico Investigation of Benzisothiazole\u2010Based Hydrazide Derivatives as Potential Anti\u2010Tuberculosis Agents"],"prefix":"10.1111","volume":"108","author":[{"given":"Vivek","family":"Sharma","sequence":"first","affiliation":[{"name":"Department of Chemistry U.G.C. Centre of Advanced Studies Guru Nanak Dev University  Amritsar India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Arun","family":"Sharma","sequence":"additional","affiliation":[{"name":"Department of Chemistry U.G.C. 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