Dublin Core The Dublin Core metadata element set is common to all Omeka records, including items, files, and collections. For more information see, http://dublincore.org/documents/dces/. Title A name given to the resource Articles Article Faculty Publications -Articles Dublin Core The Dublin Core metadata element set is common to all Omeka records, including items, files, and collections. For more information see, http://dublincore.org/documents/dces/. Title A name given to the resource Imidazopyridine chalcones as potent anticancer agents: Synthesis, single-crystal X-ray, docking, DFT and SAR studies Subject The topic of the resource anticancer; docking; imidazopyridine; SAR studies; X-ray Description An account of the resource New imidazopyridinechalcone analogs were synthesized through the ClaisenSchmidt condensation reaction. The newly synthesized imidazopyridine-chalcones (S1S12) were characterized using spectroscopic and elemental analysis. The structures of compounds S2 and S5 were confirmed by X-ray crystallography. The global chemical reactivity descriptor parameter was calculated using theoretically (DFT-B3LYP-3-211, G) estimated highest occupied molecular orbital and lowest unoccupied molecular orbital values and the results are discussed. Compounds S1S12 were screened on A-549 (lung carcinoma epithelial cells) and MDA-MB-231 (M.D. Anderson-Metastatic Breast 231) cancer cell lines. Compounds S6 and S12 displayed exceptional antiproliferative activity against lung A-549 cancer cells with IC50 values of 4.22 and 6.89 M, respectively, compared to the standard drug doxorubicin (IC50 = 3.79 ?M). In the case of the MDA-MB-231 cell line, S1 and S6 exhibited exceptionally superior antiproliferative activity with IC50 of 5.22 and 6.50 ?M, respectively, compared to doxorubicin (IC50 = 5.48 ?M). S1 was found to be more active than doxorubicin. Compounds S1S12 were tested for their cytotoxicity on human embryonic kidney 293 cells, which confirmed the nontoxic nature of the active compounds. Further molecular docking studies verified that compounds S1S12 have a higher docking score and interacted well with the target protein. The most active compound S1 interacted well with the target protein carbonic anhydrase II in complex with pyrimidine-based inhibitor, and S6 with human Topo II? ATPase/AMP-PNP. The results suggest that imidazopyridine-chalcone analogs may serve as new leads as anticancer agents. 2023 Deutsche Pharmazeutische Gesellschaft. Creator An entity primarily responsible for making the resource Soumyashree D.K.; Reddy D.S.; Nagarajaiah H.; Naik L.; Savanur H.M.; Shilpa C.D.; Sunitha Kumari M.; Shanavaz H.; Padmashali B. Source A related resource from which the described resource is derived Archiv der Pharmazie, Vol-356, No. 7 Publisher An entity responsible for making the resource available John Wiley and Sons Inc Date A point or period of time associated with an event in the lifecycle of the resource 2023-01-01 Identifier An unambiguous reference to the resource within a given context <a href="https://doi.org/10.1002/ardp.202300106" target="_blank" rel="noreferrer noopener">https://doi.org/10.1002/ardp.202300106</a> <br /><br /><a href="https://www.scopus.com/inward/record.uri?eid=2-s2.0-85159658186&amp;doi=10.1002%2Fardp.202300106&amp;partnerID=40&amp;md5=262869f749ab92f5ecb16f20f81edd62" target="_blank" rel="noreferrer noopener">https://www.scopus.com/inward/record.uri?eid=2-s2.0-85159658186&amp;doi=10.1002%2fardp.202300106&amp;partnerID=40&amp;md5=262869f749ab92f5ecb16f20f81edd62</a> Rights Information about rights held in and over the resource Restricted Access Relation A related resource ISSN: 3656233; PubMed ID: 37208792; CODEN: ARPMA Format The file format, physical medium, or dimensions of the resource Online Language A language of the resource English Type The nature or genre of the resource Article Coverage The spatial or temporal topic of the resource, the spatial applicability of the resource, or the jurisdiction under which the resource is relevant Soumyashree D.K., Department of Chemistry, School of Basic Science, Rani Channamma University, Karnataka, Belagavi, India; Reddy D.S., Centre for Nano and Material Sciences, Jain (Deemed-to-be University), Jain Global Campus, Karnataka, Bangalore, India; Nagarajaiah H., Department of Chemistry, School of Applied Sciences, REVA University, Karnataka, Bangalore, India; Naik L., Department of Physics and Electronics, CHRIST University, Karnataka, Bangalore, India; Savanur H.M., Department of Chemistry, P. C. Jabin Science College, Karnataka, Hubballi, India; Shilpa C.D., Department of Chemistry, School of Applied Sciences, REVA University, Karnataka, Bangalore, India; Sunitha Kumari M., Department of Physics, Yuvaraja's College, University of Mysore, Karnataka, Mysuru, India; Shanavaz H., Department of Chemistry, Faculty of Engineering and Technology, Jain University, Jain Global Campus, Karnataka, Bangalore, India; Padmashali B., Department of Chemistry, School of Basic Science, Rani Channamma University, Karnataka, Belagavi, India