{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,11,4]],"date-time":"2026-11-04T23:13:39Z","timestamp":1793834019112,"version":"4.6.1"},"reference-count":30,"publisher":"Informa UK Limited","issue":"2","funder":[{"DOI":"10.13039\/501100004054","name":"King Abdulaziz University","doi-asserted-by":"publisher","id":[{"id":"10.13039\/501100004054","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["www.tandfonline.com"],"crossmark-restriction":true},"short-container-title":["Journal of Biomolecular Structure and Dynamics"],"published-print":{"date-parts":[[2026,1,22]]},"DOI":"10.1080\/07391102.2025.2502137","type":"journal-article","created":{"date-parts":[[2025,5,20]],"date-time":"2025-05-20T05:46:03Z","timestamp":1747719963000},"page":"779-796","update-policy":"https:\/\/doi.org\/10.1080\/tandf_crossmark_01","source":"Crossref","is-referenced-by-count":2,"title":["Exploring a kinase inhibitor targeting PI3KCA mutant cancer cells"],"prefix":"10.1080","volume":"44","author":[{"given":"Dana F.","family":"AlKharboush","sequence":"first","affiliation":[{"name":"Department of Pharmaceutical Chemistry, Faculty of Pharmacy, King Abdulaziz University","place":["Jeddah, Saudi Arabia"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Maan T.","family":"Khayat","sequence":"additional","affiliation":[{"name":"Department of Pharmaceutical Chemistry, Faculty of Pharmacy, King Abdulaziz University","place":["Jeddah, Saudi Arabia"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Alam","family":"Jamal","sequence":"additional","affiliation":[{"name":"Department of Biochemistry, Faculty of Science, King Abdulaziz University","place":["Jeddah, Saudi Arabia"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Moustafa E.","family":"El-Araby","sequence":"additional","affiliation":[{"name":"Department of Medicinal Chemistry, School of Pharmacy, Virginia Commonwealth University","place":["Richmond, USA"]},{"name":"Department of Pharmaceutical Organic Chemistry, Faculty of Pharmacy, Helwan University","place":["Cairo, Egypt"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Aeshah A.","family":"Awaji","sequence":"additional","affiliation":[{"name":"Department of Biology, Faculty of Science, University College of Taymaa, University of Tabuk","place":["Tabuk, Saudi Arabia"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Mohammad Imran","family":"Khan","sequence":"additional","affiliation":[{"name":"Research Center, King Faisal Specialist Hospital and Research Center","place":["Jeddah, Saudi Arabia"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Abdelsattar M.","family":"Omar","sequence":"additional","affiliation":[{"name":"Department of Pharmaceutical Chemistry, Faculty of Pharmacy, King Abdulaziz University","place":["Jeddah, Saudi Arabia"]}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"301","published-online":{"date-parts":[[2025,5,19]]},"reference":[{"key":"e_1_3_5_2_1","unstructured":"Cancer Today. 2023. http:\/\/gco.iarc.fr\/today\/home"},{"key":"e_1_3_5_3_1","doi-asserted-by":"publisher","DOI":"10.4155\/fmc-2021-0049"},{"key":"e_1_3_5_4_1","doi-asserted-by":"publisher","DOI":"10.4155\/fmc-2018-0361"},{"key":"e_1_3_5_5_1","doi-asserted-by":"publisher","DOI":"10.1007\/s11912-019-0846-7"},{"key":"e_1_3_5_6_1","doi-asserted-by":"publisher","DOI":"10.1038\/nrd4204"},{"key":"e_1_3_5_7_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.cell.2017.07.029"},{"key":"e_1_3_5_8_1","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jmedchem.2c01422"},{"key":"e_1_3_5_9_1","doi-asserted-by":"publisher","DOI":"10.3389\/fphar.2021.675675"},{"key":"e_1_3_5_10_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.sjbs.2023.103569"},{"key":"e_1_3_5_11_1","doi-asserted-by":"publisher","DOI":"10.1080\/07391102.2022.2132293"},{"key":"e_1_3_5_12_1","doi-asserted-by":"publisher","DOI":"10.1146\/annurev.cellbio.17.1.615"},{"key":"e_1_3_5_13_1","doi-asserted-by":"publisher","DOI":"10.3389\/FPHAR.2021.794325"},{"key":"e_1_3_5_14_1","doi-asserted-by":"publisher","DOI":"10.4161\/cc.8.9.8255"},{"key":"e_1_3_5_15_1","doi-asserted-by":"publisher","DOI":"10.3390\/ijms22073464"},{"key":"e_1_3_5_16_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.molstruc.2013.01.054"},{"key":"e_1_3_5_17_1","doi-asserted-by":"publisher","DOI":"10.3389\/fonc.2022.819128"},{"key":"e_1_3_5_18_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.phrs.2022.106552"},{"key":"e_1_3_5_19_1","doi-asserted-by":"publisher","DOI":"10.1126\/science.1096502"},{"key":"e_1_3_5_20_1","volume-title":"QikProp","author":"Schr\u00f6dinger Release 2023-3","year":"2023","unstructured":"Schr\u00f6dinger Release 2023-3. (2023a). QikProp. Schr\u00f6dinger, LLC."},{"key":"e_1_3_5_21_1","volume-title":"Protein Preparation Wizard; Epik","author":"Schr\u00f6dinger Release 2023-3","year":"2023","unstructured":"Schr\u00f6dinger Release 2023-3. (2023b). Protein Preparation Wizard; Epik. Schr\u00f6dinger, LLC."},{"key":"e_1_3_5_22_1","volume-title":"LigPrep","author":"Schr\u00f6dinger Release 2023-3","year":"2023","unstructured":"Schr\u00f6dinger Release 2023-3. (2023c). LigPrep. Schr\u00f6dinger, LLC."},{"key":"e_1_3_5_23_1","volume-title":"Epik","author":"Schr\u00f6dinger Release 2023-3","year":"2023","unstructured":"Schr\u00f6dinger Release 2023-3. (2023d). Epik. Schr\u00f6dinger, LLC."},{"key":"e_1_3_5_24_1","volume-title":"Glide","author":"Schr\u00f6dinger Release 2023-3","year":"2023","unstructured":"Schr\u00f6dinger Release 2023-3. (2023e). Glide. Schr\u00f6dinger, LLC."},{"key":"e_1_3_5_25_1","volume-title":"Desmond Molecular Dynamics System. D. E. Shaw Research, New York, NY, 2023.","author":"Schr\u00f6dinger Release 2023-3","year":"2023","unstructured":"Schr\u00f6dinger Release 2023-3. (2023f). Desmond Molecular Dynamics System. D. E. Shaw Research, New York, NY, 2023. Maestro-Desmond Interoperability Tools, Schr\u00f6dinger."},{"key":"e_1_3_5_26_1","doi-asserted-by":"publisher","DOI":"10.3322\/caac.21763"},{"key":"e_1_3_5_27_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.apsb.2022.02.002"},{"key":"e_1_3_5_28_1","doi-asserted-by":"publisher","DOI":"10.3322\/caac.21660"},{"key":"e_1_3_5_29_1","unstructured":"The Cancer Genome Atlas. (2023). Network Comprehensive Molecular Portraits of Human Breast Tumours https:\/\/www.nature.com\/articles\/nature11412"},{"key":"e_1_3_5_30_1","doi-asserted-by":"publisher","DOI":"10.1038\/s41568-019-0213-x"},{"key":"e_1_3_5_31_1","doi-asserted-by":"publisher","DOI":"10.3389\/fphar.2021.801662"}],"container-title":["Journal of Biomolecular Structure and Dynamics"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/www.tandfonline.com\/doi\/pdf\/10.1080\/07391102.2025.2502137","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,2,16]],"date-time":"2026-02-16T12:14:06Z","timestamp":1771244046000},"score":1,"resource":{"primary":{"URL":"https:\/\/www.tandfonline.com\/doi\/full\/10.1080\/07391102.2025.2502137"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2025,5,19]]},"references-count":30,"journal-issue":{"issue":"2","published-print":{"date-parts":[[2026,1,22]]}},"alternative-id":["10.1080\/07391102.2025.2502137"],"URL":"https:\/\/doi.org\/10.1080\/07391102.2025.2502137","relation":{},"ISSN":["0739-1102","1538-0254"],"issn-type":[{"value":"0739-1102","type":"print"},{"value":"1538-0254","type":"electronic"}],"subject":[],"published":{"date-parts":[[2025,5,19]]},"assertion":[{"value":"The publishing and review policy for this title is described in its Aims & Scope.","order":1,"name":"peerreview_statement","label":"Peer Review Statement"},{"value":"http:\/\/www.tandfonline.com\/action\/journalInformation?show=aimsScope&journalCode=tbsd20","URL":"http:\/\/www.tandfonline.com\/action\/journalInformation?show=aimsScope&journalCode=tbsd20","order":2,"name":"aims_and_scope_url","label":"Aim & Scope"},{"value":"2023-12-18","order":0,"name":"received","label":"Received","group":{"name":"publication_history","label":"Publication History"}},{"value":"2024-05-04","order":2,"name":"accepted","label":"Accepted","group":{"name":"publication_history","label":"Publication History"}},{"value":"2025-05-19","order":3,"name":"published","label":"Published","group":{"name":"publication_history","label":"Publication History"}}]}}