02258nas a2200265   4500008004100000022001400041245015900055210006900214260000800283300001400291490000700305520133500312653001401647653002201661653002801683653002301711653001401734653001601748100001801764700002601782700001601808700001501824700002101839856013201860       2024                        eng d  a1570-180800aDesign, synthesis, anti-inflammatory evaluation and in silico molecular docking of novel furan-based derivatives as potential TNF-α production inhibitors0 aDesign synthesis antiinflammatory evaluation and in silico molec  cJAN  a2916-29250 v213 a<p>
	Introduction Inflammation is the first response and an alarming signal for the onset of chronic disease. Most of the anti-inflammatory drugs available in the market are reported to have undesirable gastrointestinal toxicities. Therefore, it is of urgent significance to develop anti-inflammatory drugs with low toxicity and good efficacy.Methods We created a targeted scaffold based on a literature review by combining the different structural characteristics of furan and benzyl amides into a single pharmacophore. A series of eighteen furan-based derivatives (1-18) were designed, synthesized for in vitro and in vivo anti-inflammatory activity. The characterization of synthesized compounds was elucidated by techniques like 1H-NMR, 13C-NMR, FT-IR and MS.Results The synthetic compounds were examined through molecular docking studies on TNF-alpha for probable binding mode and interactions with hydrophilic and hydrophobic pocket of TNF-alpha in comparison to standard drug (Indomethacin).Conclusion When compared to the standard treatment, compounds 18, 15 and 9 displayed a remarkable inhibitory effect on the production of TNF-alpha and in vivo inflammatory activity with no damage to stomach and reduction of LPO. The compounds 18, 15 and 9 might be a good consideration for potential anti-inflammatory agents.</p>
10aanalgesic10aAnti-inflammatory10aFuran-based derivatives10aLipid peroxidation10aTNF-alpha10aulcerogenic1 aBhoge, Satish1 aSingh, Prabal, Pratap1 aDas, Deepak1 aAli, Yakub1 aDhulap, Abhijeet  uhttps://library.ncl.res.in/content/design-synthesis-anti-inflammatory-evaluation-and-silico-molecular-docking-novel-furan-based