{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,9,9]],"date-time":"2026-09-09T22:30:57Z","timestamp":1788993057760,"version":"build-2803163510"},"reference-count":61,"publisher":"Wiley","issue":"10","license":[{"start":{"date-parts":[[2023,4,26]],"date-time":"2023-04-26T00:00:00Z","timestamp":1682467200000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/onlinelibrary.wiley.com\/termsAndConditions#vor"}],"content-domain":{"domain":["aces.onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["Chemistry \u0097 An Asian Journal"],"published-print":{"date-parts":[[2023,5,16]]},"abstract":"<jats:title>Abstract<\/jats:title><jats:p>Antimicrobial resistance is a serious public health risk. Its severity is fueled on an unprecedented scale, necessitating the demand for novel antimicrobial scaffolds aimed at novel targets. Herein, we present cationic chlorpromazine peptide conjugates that are rationally intended to targetmultidrug\u2010resistant (MDR) bacteria. The most potent compound, <jats:bold>CPWL<\/jats:bold>, of all the conjugates evaluated, showed promising antibacterial activity against clinical, MDR <jats:italic>S. aureus<\/jats:italic>, with no cytotoxicity. The molecular docking experiments confirmed that <jats:bold>CPWL<\/jats:bold> possessed a very high affinity for <jats:italic>S. aureus<\/jats:italic> enoyl reductase (saFabI). Furthermore, <jats:bold>CPWL<\/jats:bold> antibacterial action against saFabI was further corroborated by MD simulation studies. Thus, our findings highlight cationic chlorpromazine as a promising scaffold for the development of saFabI inhibitors to target severe staphylococcal infections.<\/jats:p>","DOI":"10.1002\/asia.202300169","type":"journal-article","created":{"date-parts":[[2023,4,18]],"date-time":"2023-04-18T13:08:43Z","timestamp":1681823323000},"update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":7,"title":["Targeting multidrug resistant <i>Staphylococcus aureus<\/i> with cationic chlorpromazine\u2010peptide conjugates"],"prefix":"10.1002","volume":"18","author":[{"given":"Apurva","family":"Panjla","sequence":"first","affiliation":[{"name":"Department of Chemistry Indian Institute of Technology Kanpur  Kanpur 208016 UP India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Grace","family":"Kaul","sequence":"additional","affiliation":[{"name":"Department of Molecular Microbiology and Immunology CSIR-Central Drug Research Institute, Sector 10  Sitapur Road, Janakipuram Extension Lucknow 226031 UP India"},{"name":"AcSIR: Academy of Scientific and Innovative Research (AcSIR)  Ghaziabad 201002 India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Abdul","family":"Akhir","sequence":"additional","affiliation":[{"name":"Mehta Family Center for Engineering in Medicine Center for Nanoscience Indian Institute of Technology Kanpur  Kanpur 208016 UP India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Deepanshi","family":"Saxena","sequence":"additional","affiliation":[{"name":"Department of Molecular Microbiology and Immunology CSIR-Central Drug Research Institute, Sector 10  Sitapur Road, Janakipuram Extension Lucknow 226031 UP India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Saurabh","family":"Joshi","sequence":"additional","affiliation":[{"name":"Department of Chemistry Indian Institute of Technology Kanpur  Kanpur 208016 UP India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Chandrima","family":"Modak","sequence":"additional","affiliation":[{"name":"Department of Bioengineering and Biotechnology Birla Institute of Technology Mesra  Ranchi 835215 Jharkhand India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Dipti","family":"Kumari","sequence":"additional","affiliation":[{"name":"Department of Bioengineering and Biotechnology Birla Institute of Technology Mesra  Ranchi 835215 Jharkhand India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Alok","family":"Jain","sequence":"additional","affiliation":[{"name":"Department of Bioengineering and Biotechnology Birla Institute of Technology Mesra  Ranchi 835215 Jharkhand India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Sidharth","family":"Chopra","sequence":"additional","affiliation":[{"name":"Department of Molecular Microbiology and Immunology CSIR-Central Drug Research Institute, Sector 10  Sitapur Road, Janakipuram Extension Lucknow 226031 UP India"},{"name":"AcSIR: Academy of Scientific and Innovative Research (AcSIR)  Ghaziabad 201002 India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Sandeep","family":"Verma","sequence":"additional","affiliation":[{"name":"Department of Chemistry Indian Institute of Technology Kanpur  Kanpur 208016 UP India"},{"name":"Mehta Family Center for Engineering in Medicine Center for Nanoscience Indian Institute of Technology Kanpur  Kanpur 208016 UP India"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"311","published-online":{"date-parts":[[2023,4,26]]},"reference":[{"key":"e_1_2_7_1_1","unstructured":"\u00a0"},{"key":"e_1_2_7_2_2","doi-asserted-by":"publisher","DOI":"10.1016\/j.mib.2007.08.003"},{"key":"e_1_2_7_3_2","doi-asserted-by":"publisher","DOI":"10.1086\/595011"},{"key":"e_1_2_7_4_1","doi-asserted-by":"publisher","DOI":"10.1093\/cid\/ciac364"},{"key":"e_1_2_7_5_1","doi-asserted-by":"publisher","DOI":"10.3389\/fmicb.2018.02705"},{"key":"e_1_2_7_6_1","doi-asserted-by":"publisher","DOI":"10.3389\/fmicb.2015.00282"},{"key":"e_1_2_7_7_1","unstructured":"\u00a0"},{"key":"e_1_2_7_8_2","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.2023467118"},{"key":"e_1_2_7_9_2","doi-asserted-by":"publisher","DOI":"10.1038\/s41579-018-0141-x"},{"key":"e_1_2_7_10_2","doi-asserted-by":"publisher","DOI":"10.1042\/EBC20160058"},{"key":"e_1_2_7_11_2","doi-asserted-by":"publisher","DOI":"10.1093\/jac\/dkq108"},{"key":"e_1_2_7_12_1","unstructured":"\u00a0"},{"key":"e_1_2_7_13_2","doi-asserted-by":"publisher","DOI":"10.1128\/CMR.00077-17"},{"key":"e_1_2_7_14_2","doi-asserted-by":"publisher","DOI":"10.1021\/acscombsci.0c00060"},{"key":"e_1_2_7_15_2","doi-asserted-by":"publisher","DOI":"10.1002\/pep2.24059"},{"key":"e_1_2_7_16_1","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pone.0189950"},{"key":"e_1_2_7_17_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.bmcl.2020.127670"},{"key":"e_1_2_7_18_1","doi-asserted-by":"publisher","DOI":"10.1128\/JB.00344-21"},{"key":"e_1_2_7_19_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41598-020-74752-z"},{"key":"e_1_2_7_20_1","doi-asserted-by":"publisher","DOI":"10.3390\/coatings10121230"},{"key":"e_1_2_7_21_1","doi-asserted-by":"publisher","DOI":"10.1002\/jcb.28049"},{"key":"e_1_2_7_22_1","first-page":"146","volume":"5","author":"Heath R. J.","year":"2004","journal-title":"Curr. Opin. Investig. Drugs (London, England: 2000)"},{"key":"e_1_2_7_23_1","doi-asserted-by":"publisher","DOI":"10.1021\/bi800023a"},{"key":"e_1_2_7_24_1","unstructured":"\u00a0"},{"key":"e_1_2_7_25_2","doi-asserted-by":"publisher","DOI":"10.1042\/bj20021699"},{"key":"e_1_2_7_26_2","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.M005611200"},{"key":"e_1_2_7_27_2","doi-asserted-by":"publisher","DOI":"10.1074\/jbc.M708171200"},{"key":"e_1_2_7_28_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.str.2012.03.013"},{"key":"e_1_2_7_29_1","doi-asserted-by":"publisher","DOI":"10.1038\/nsmb899"},{"key":"e_1_2_7_30_1","doi-asserted-by":"publisher","DOI":"10.1021\/acschembio.1c00626"},{"key":"e_1_2_7_31_1","unstructured":"\u00a0"},{"key":"e_1_2_7_32_2","doi-asserted-by":"publisher","DOI":"10.1021\/acsomega.0c01355"},{"key":"e_1_2_7_33_2","doi-asserted-by":"publisher","DOI":"10.1021\/acsinfecdis.0c00037"},{"key":"e_1_2_7_34_2","doi-asserted-by":"publisher","DOI":"10.1073\/pnas.1704125114"},{"key":"e_1_2_7_35_1","doi-asserted-by":"publisher","DOI":"10.1039\/C9CC03001H"},{"key":"e_1_2_7_36_1","doi-asserted-by":"publisher","DOI":"10.1016\/0021-9991(83)90014-1"},{"key":"e_1_2_7_37_1","unstructured":"\u00a0"},{"key":"e_1_2_7_38_2","doi-asserted-by":"publisher","DOI":"10.1002\/anie.201915407"},{"key":"e_1_2_7_38_3","doi-asserted-by":"publisher","DOI":"10.1002\/ange.201915407"},{"key":"e_1_2_7_39_2","doi-asserted-by":"publisher","DOI":"10.1016\/j.chembiol.2010.01.014"},{"key":"e_1_2_7_40_2","doi-asserted-by":"publisher","DOI":"10.1039\/C7SC01670K"},{"key":"e_1_2_7_41_1","doi-asserted-by":"publisher","DOI":"10.1021\/bi5014358"},{"key":"e_1_2_7_42_1","doi-asserted-by":"publisher","DOI":"10.1021\/bi400413c"},{"key":"e_1_2_7_43_1","doi-asserted-by":"publisher","DOI":"10.1007\/s10822-013-9644-8"},{"key":"e_1_2_7_44_1","doi-asserted-by":"publisher","DOI":"10.1093\/nar\/28.1.235"},{"key":"e_1_2_7_45_1","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20292"},{"key":"e_1_2_7_46_1","doi-asserted-by":"publisher","DOI":"10.1111\/j.1747-0285.2007.00483.x"},{"key":"e_1_2_7_47_1","doi-asserted-by":"publisher","DOI":"10.1021\/ci800324m"},{"key":"e_1_2_7_48_1","doi-asserted-by":"publisher","DOI":"10.1021\/jm051256o"},{"key":"e_1_2_7_49_1","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20945"},{"key":"e_1_2_7_50_1","doi-asserted-by":"publisher","DOI":"10.1021\/ct300400x"},{"key":"e_1_2_7_51_1","unstructured":"\u00a0"},{"key":"e_1_2_7_52_2","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21367"},{"key":"e_1_2_7_53_2","unstructured":"S. Kim J. Lee S. Jo C.\u2005L. Brooks III H.\u2005S. Lee W. Im Wiley Online Library J. Comput. Chem 2017."},{"key":"e_1_2_7_54_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.445869"},{"key":"e_1_2_7_55_1","doi-asserted-by":"publisher","DOI":"10.1063\/1.470117"},{"key":"e_1_2_7_56_1","doi-asserted-by":"publisher","DOI":"10.1002\/bdd.780"},{"key":"e_1_2_7_57_1","unstructured":"\u00a0"},{"key":"e_1_2_7_58_2","doi-asserted-by":"publisher","DOI":"10.1063\/1.444641"},{"key":"e_1_2_7_59_2","doi-asserted-by":"publisher","DOI":"10.1063\/1.328693"},{"key":"e_1_2_7_60_1","doi-asserted-by":"publisher","DOI":"10.1016\/0263-7855(96)00018-5"}],"container-title":["Chemistry \u2013 An Asian Journal"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/aces.onlinelibrary.wiley.com\/doi\/pdf\/10.1002\/asia.202300169","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2025,10,8]],"date-time":"2025-10-08T11:59:40Z","timestamp":1759924780000},"score":1,"resource":{"primary":{"URL":"https:\/\/aces.onlinelibrary.wiley.com\/doi\/10.1002\/asia.202300169"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2023,4,26]]},"references-count":61,"journal-issue":{"issue":"10","published-print":{"date-parts":[[2023,5,16]]}},"alternative-id":["10.1002\/asia.202300169"],"URL":"https:\/\/doi.org\/10.1002\/asia.202300169","archive":["Portico"],"relation":{},"ISSN":["1861-4728","1861-471X"],"issn-type":[{"value":"1861-4728","type":"print"},{"value":"1861-471X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2023,4,26]]},"assertion":[{"value":"2023-02-27","order":0,"name":"received","label":"Received","group":{"name":"publication_history","label":"Publication History"}},{"value":"2023-04-26","order":3,"name":"published","label":"Published","group":{"name":"publication_history","label":"Publication History"}}],"article-number":"e202300169"}}