{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,7]],"date-time":"2026-10-07T13:03:55Z","timestamp":1791378235794,"version":"4.3.2"},"reference-count":50,"publisher":"Wiley","issue":"5","license":[{"start":{"date-parts":[[2026,4,2]],"date-time":"2026-04-02T00:00:00Z","timestamp":1775088000000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/onlinelibrary.wiley.com\/termsAndConditions#vor"},{"start":{"date-parts":[[2026,4,2]],"date-time":"2026-04-02T00:00:00Z","timestamp":1775088000000},"content-version":"tdm","delay-in-days":0,"URL":"http:\/\/doi.wiley.com\/10.1002\/tdm_license_1.1"}],"content-domain":{"domain":["iubmb.onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["Biotech and App Biochem"],"published-print":{"date-parts":[[2026,10]]},"abstract":"<jats:title>ABSTRACT<\/jats:title>\n                  <jats:p>\n                    In this study, a series of novel sulfonamide derivatives containing the piperazine moiety was synthesized via the Povarov reaction. Subsequently, these compounds were characterized using\n                    <jats:sup>1<\/jats:sup>\n                    H NMR,\n                    <jats:sup>13<\/jats:sup>\n                    C NMR, IR spectroscopy, and mass spectroscopy analysis to determine their structural integrity. The inhibitory effects of these sulfonamide derivatives on the glutathione S\u2010transferase pi 1 (GSTP1\u20101) enzyme were evaluated, with ethacrynic acid (INN) serving as a standard inhibitor for comparison. The half\u2010maximal inhibitory concentration (IC\n                    <jats:sub>50<\/jats:sub>\n                    ) values for secondary amine and synthesized piperazine\u2010linked sulfonamide derivatives (PLSDs) were determined to range from 0.33 to 0.86\u00a0\u00b5M, indicating significant inhibitory potential. Lineweaver\u2013Burk plots were constructed for each inhibitor, and the inhibition constant (K\n                    <jats:sub>i<\/jats:sub>\n                    ) values were calculated, ranging from 1.443\u00a0\u00b1\u00a00.562 to 4.192\u00a0\u00b1\u00a00.125\u00a0\u00b5M. Molecular docking simulations further supported the experimental findings, revealing binding energies between \u22125.9 and \u22129.2\u00a0kcal\/mol, suggesting strong interactions between the sulfonamide derivatives and the GSTP1\u20101 active site. Molecular dynamics (MDs) studies were performed to further investigate the interaction, orientation, and conformation of the PLSDs over the active site of GSTP1\u20101. In silico drug\u2010likeness analysis and ADMET predictions of the PLSDs demonstrated that PLSDs showed drug\u2010likeness and had a satisfactory ADMET profile. The structural insights gained from this study offer valuable guidance for the rational design of more potent GSTP1\u20101 inhibitors, emphasizing the relevance of these scaffolds for future therapeutic developments aimed at targeting GSTP1\u20101 enzymes.\n                  <\/jats:p>","DOI":"10.1002\/bab.70172","type":"journal-article","created":{"date-parts":[[2026,4,3]],"date-time":"2026-04-03T06:45:52Z","timestamp":1775198752000},"page":"2286-2298","update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":0,"title":["Synthesis of Piperazine\u2010Linked Sulfonamide Derivatives and Their Inhibitory Effects on Glutathione S\u2010Transferase: In Vitro and In Silico Approach"],"prefix":"10.1002","volume":"73","author":[{"given":"Tuba","family":"\u00c7elik","sequence":"first","affiliation":[{"name":"Postgraduate Education Institute Igd\u0131r University  Igd\u0131r 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