naa a22 4500 51073359X CHVBK 20180411083001.0 cr unu---uuuuu 180411e20131101xx s 000 0 eng 10.1007/s12039-013-0489-4 doi (NATIONALLICENCE)springer-10.1007/s12039-013-0489-4 Design, synthesis and computational validation of novel benzimidazole/indole-based PPAR α and PPAR γ partial agonists [Elektronische Daten] [RAMAN VERMA, PRITHWISH GHOSH, VIJAY KUMAR, LALIT WADHWA] The design and synthesis of benzimidazolyl and indolyl linked α-alkoxy phenylpropanoic acid derivatives and the β-keto ester analogues in an effort to develop novel peroxisome proliferator activated receptors ligands expected to exhibit PPARα and PPARγ partial agonism in the management of hyperglycemia and hyperlipidemia for the treatment of type 2 diabetes is reported. Computational validation of the designed molecules through activity prediction and docking studies showed expected results. Graphical Abstract Syntheses of benzimidazole and indole linked benzyl based α-alkoxy propanoic acids and benzylidene and benzyl based β-ketoesters, as partial PPARα/γ agonists as Anti Type 2 Diabetic compounds, followed by their activity and binding affinity prediction at individual PPARs to support the design of the molecules with expected partial agonism, are reported. Indian Academy of Sciences, 2013 β -keto ester nationallicence α -alkoxy acid nationallicence PPAR nationallicence partial agonism nationallicence VERMA RAMAN Synthetic Organic and Medicinal Chemistry Laboratory, Department of Chemistry, Punjabi University, 147 002, Patiala, India aut GHOSH PRITHWISH Synthetic Organic and Medicinal Chemistry Laboratory, Department of Chemistry, Punjabi University, 147 002, Patiala, India aut KUMAR VIJAY Synthetic Organic and Medicinal Chemistry Laboratory, Department of Chemistry, Punjabi University, 147 002, Patiala, India aut WADHWA LALIT Ind-Swift Laboratories Limited (Research and Development Centre), Plot No. E-5, Industrial Area, Phase-2, SAS Nagar, 160 055, Mohali, India aut Journal of Chemical Sciences Springer India 125/6(2013-11-01), 1555-1571 0974-3626 125:6<1555 2013 125 12039 https://doi.org/10.1007/s12039-013-0489-4 text/html Onlinezugriff via DOI 1 brief-communication jats NATIONALLICENCE 856 40 https://doi.org/10.1007/s12039-013-0489-4 text/html Onlinezugriff via DOI NATIONALLICENCE 700 1- VERMA RAMAN Synthetic Organic and Medicinal Chemistry Laboratory, Department of Chemistry, Punjabi University, 147 002, Patiala, India aut NATIONALLICENCE 700 1- GHOSH PRITHWISH Synthetic Organic and Medicinal Chemistry Laboratory, Department of Chemistry, Punjabi University, 147 002, Patiala, India aut NATIONALLICENCE 700 1- KUMAR VIJAY Synthetic Organic and Medicinal Chemistry Laboratory, Department of Chemistry, Punjabi University, 147 002, Patiala, India aut NATIONALLICENCE 700 1- WADHWA LALIT Ind-Swift Laboratories Limited (Research and Development Centre), Plot No. E-5, Industrial Area, Phase-2, SAS Nagar, 160 055, Mohali, India aut NATIONALLICENCE 773 0- Journal of Chemical Sciences Springer India 125/6(2013-11-01), 1555-1571 0974-3626 125:6<1555 2013 125 12039 Metadata rights reserved Springer special CC-BY-NC licence nationallicence BK010053 XK010053 XK010000 NATIONALLICENCE NATIONALLICENCE NL-springer