{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,8,18]],"date-time":"2026-08-18T00:46:23Z","timestamp":1787013983856,"version":"build-2736575974"},"reference-count":25,"publisher":"Wiley","issue":"4","license":[{"start":{"date-parts":[[2015,3,1]],"date-time":"2015-03-01T00:00:00Z","timestamp":1425168000000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/onlinelibrary.wiley.com\/termsAndConditions#vor"}],"funder":[{"name":"HNF (Hamdard National Fellowship)"}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["Chem Biol Drug Des"],"published-print":{"date-parts":[[2015,10]]},"abstract":"<jats:p>\n                    A focused library of novel benzyl pyrrolones has been synthesized and their\n                    <jats:italic>in silico<\/jats:italic>\n                    molecular docking studies carried out against\n                    <jats:styled-content style=\"fixed-case\">TNF<\/jats:styled-content>\n                    \u2010\n                    <jats:italic>\u03b1<\/jats:italic>\n                    target. Among all the docked molecules, compound\n                    <jats:bold>3f<\/jats:bold>\n                    showed best glide score of \u22126.89. All the synthesized compounds were evaluated for in vivo anti\u2010inflammatory activity by carrageenan\u2010induced paw edema model. Compounds showing significant anti\u2010inflammatory activity were further tested for their\n                    <jats:italic>in vitro<\/jats:italic>\n                    <jats:styled-content style=\"fixed-case\">TNF<\/jats:styled-content>\n                    <jats:italic>\u03b1<\/jats:italic>\n                    expression. Compounds\n                    <jats:bold>3b<\/jats:bold>\n                    and\n                    <jats:bold>2b<\/jats:bold>\n                    were found to show significant inhibition of 76.22% and 71.47%, respectively after 5\u00a0h in comparison with standard drug indomethacin, which showed 80.98% inhibition of inflammation. Compounds\n                    <jats:bold>3b<\/jats:bold>\n                    and\n                    <jats:bold>2b<\/jats:bold>\n                    also suppressed\n                    <jats:styled-content style=\"fixed-case\">TNF<\/jats:styled-content>\n                    <jats:italic>\u03b1<\/jats:italic>\n                    level by 65.03% and 60.90% as compared indomethacin, which showed 68.84% of inhibition. Compound\n                    <jats:bold>3b<\/jats:bold>\n                    showed significant analgesic activity of 60.04%, and its activity was comparable with indomethacin (64.04%). Compounds\n                    <jats:bold>3b<\/jats:bold>\n                    and\n                    <jats:bold>2b<\/jats:bold>\n                    were also tested for their effect on protein expression of\n                    <jats:styled-content style=\"fixed-case\">COX<\/jats:styled-content>\n                    \u20102 and\n                    <jats:styled-content style=\"fixed-case\">NF<\/jats:styled-content>\n                    \u2010\n                    <jats:italic>\u03ba<\/jats:italic>\n                    B in the liver tissues. Compounds\n                    <jats:bold>3b<\/jats:bold>\n                    and\n                    <jats:bold>2b<\/jats:bold>\n                    were further evaluated for their gastric risk and lipid peroxidation action and showed superior\n                    <jats:styled-content style=\"fixed-case\">GI<\/jats:styled-content>\n                    safety along with reduction of\n                    <jats:styled-content style=\"fixed-case\">LPO<\/jats:styled-content>\n                    as compared to indomethacin. Hepatotoxicity study showed that these two compounds did not cause any damage to liver.\n                  <\/jats:p>","DOI":"10.1111\/cbdd.12522","type":"journal-article","created":{"date-parts":[[2015,1,28]],"date-time":"2015-01-28T06:33:52Z","timestamp":1422426832000},"page":"619-625","source":"Crossref","is-referenced-by-count":16,"title":["Design and Synthesis of Butenolide\u2010based Novel Benzyl Pyrrolones: Their TNF\u2010\n                    <i>\u03b1<\/i>\n                    based Molecular Docking with\n                    <i>In vivo<\/i>\n                    and\n                    <i>In vitro<\/i>\n                    Anti\u2010inflammatory Activity"],"prefix":"10.1111","volume":"86","author":[{"given":"Yakub","family":"Ali","sequence":"first","affiliation":[{"name":"Department of Chemistry Faculty of Science Jamia Hamdard (Hamdard University) New Delhi 110 062 India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Mohammad 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India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Abhijeet","family":"Dhulap","sequence":"additional","affiliation":[{"name":"CSIR Unit for Research and Development of Information Products Pune 411038 India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Firasat","family":"Hussain","sequence":"additional","affiliation":[{"name":"Department of Chemistry Faculty of Science Delhi University New Delhi India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Sameena","family":"Bano","sequence":"additional","affiliation":[{"name":"Department of Chemistry Faculty of Science Jamia Hamdard (Hamdard University) New Delhi 110 062 India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Chetna","family":"Kharbanda","sequence":"additional","affiliation":[{"name":"Department of Chemistry Faculty of Science Jamia Hamdard (Hamdard University) New Delhi 110 062 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