{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,8,19]],"date-time":"2026-08-19T20:16:53Z","timestamp":1787170613710,"version":"build-2736575974"},"reference-count":23,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2025,6,1]],"date-time":"2025-06-01T00:00:00Z","timestamp":1748736000000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2025,6,1]],"date-time":"2025-06-01T00:00:00Z","timestamp":1748736000000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/legal\/tdmrep-license"},{"start":{"date-parts":[[2025,6,1]],"date-time":"2025-06-01T00:00:00Z","timestamp":1748736000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-017"},{"start":{"date-parts":[[2025,6,1]],"date-time":"2025-06-01T00:00:00Z","timestamp":1748736000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2025,6,1]],"date-time":"2025-06-01T00:00:00Z","timestamp":1748736000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-012"},{"start":{"date-parts":[[2025,6,1]],"date-time":"2025-06-01T00:00:00Z","timestamp":1748736000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2025,6,1]],"date-time":"2025-06-01T00:00:00Z","timestamp":1748736000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-004"}],"funder":[{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["82404067"],"award-info":[{"award-number":["82404067"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100017683","name":"Dalian Science and Technology Innovation Fund","doi-asserted-by":"publisher","award":["2024JJ13PT056"],"award-info":[{"award-number":["2024JJ13PT056"]}],"id":[{"id":"10.13039\/501100017683","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Bioorganic Chemistry"],"published-print":{"date-parts":[[2025,6]]},"DOI":"10.1016\/j.bioorg.2025.108480","type":"journal-article","created":{"date-parts":[[2025,4,16]],"date-time":"2025-04-16T11:44:14Z","timestamp":1744803854000},"page":"108480","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":1,"special_numbering":"C","title":["Identification of novel AURKA inhibitors against neuroblastoma using a virtual screening approach"],"prefix":"10.1016","volume":"160","author":[{"given":"Hongli","family":"Yin","sequence":"first","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Xue","family":"Dong","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Tianyi","family":"Liu","sequence":"additional","affiliation":[],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"78","reference":[{"key":"10.1016\/j.bioorg.2025.108480_bb0005","doi-asserted-by":"crossref","first-page":"1337","DOI":"10.1093\/jnci\/djad115","article-title":"Counts, incidence rates, and trends of pediatric cancer in the United States, 2003\u20132019","volume":"115","author":"Siegel","year":"2023","journal-title":"J. Natl. Cancer Inst."},{"key":"10.1016\/j.bioorg.2025.108480_bb0010","doi-asserted-by":"crossref","first-page":"3829","DOI":"10.21873\/anticanres.16570","article-title":"New approaches towards targeted therapy for childhood neuroblastoma","volume":"43","author":"Dalianis","year":"2023","journal-title":"Anticancer Res."},{"key":"10.1016\/j.bioorg.2025.108480_bb0015","doi-asserted-by":"crossref","DOI":"10.1101\/cshperspect.a014415","article-title":"Neuroblastoma and MYCN","volume":"3","author":"Huang","year":"2013","journal-title":"Cold Spring Harb. Perspect. Med."},{"key":"10.1016\/j.bioorg.2025.108480_bb0020","article-title":"MYCN function in neuroblastoma development","volume":"10","author":"Otte","year":"2020","journal-title":"Front. Oncol."},{"key":"10.1016\/j.bioorg.2025.108480_bb0025","doi-asserted-by":"crossref","first-page":"3008","DOI":"10.1200\/JCO.2014.59.4648","article-title":"Advances in risk classification and treatment strategies for neuroblastoma","volume":"33","author":"Pinto","year":"2015","journal-title":"J. Clin. Oncol."},{"key":"10.1016\/j.bioorg.2025.108480_bb0030","doi-asserted-by":"crossref","first-page":"1627","DOI":"10.1158\/0008-5472.CAN-20-3108","article-title":"Drugging the \u2018undruggable\u2019 MYCN oncogenic transcription factor: overcoming previous obstacles to impact childhood cancers","volume":"81","author":"Wolpaw","year":"2021","journal-title":"Cancer Res."},{"key":"10.1016\/j.bioorg.2025.108480_bb0035","doi-asserted-by":"crossref","first-page":"355","DOI":"10.1080\/21678707.2017.1304212","article-title":"Emerging and investigational therapies for neuroblastoma","volume":"5","author":"Applebaum","year":"2017","journal-title":"Expert Opin orphan Drugs"},{"key":"10.1016\/j.bioorg.2025.108480_bb0040","doi-asserted-by":"crossref","first-page":"4421","DOI":"10.3390\/cancers14184421","article-title":"MYCN impact on high-risk neuroblastoma: from diagnosis and prognosis to targeted treatment","volume":"14","author":"Bartolucci","year":"2022","journal-title":"Cancers (Basel)"},{"key":"10.1016\/j.bioorg.2025.108480_bb0045","doi-asserted-by":"crossref","first-page":"1881","DOI":"10.1038\/s41467-021-22143-x","article-title":"An ALYREF-MYCN coactivator complex drives neuroblastoma tumorigenesis through effects on USP3 and MYCN stability","volume":"12","author":"Nagy","year":"2021","journal-title":"Nat. Commun."},{"key":"10.1016\/j.bioorg.2025.108480_bb0050","doi-asserted-by":"crossref","first-page":"1572","DOI":"10.1016\/j.biocel.2005.02.021","article-title":"Aurora kinases","volume":"37","author":"Bolanos-Garcia","year":"2005","journal-title":"Int. J. Biochem. Cell Biol."},{"key":"10.1016\/j.bioorg.2025.108480_bb0055","doi-asserted-by":"crossref","first-page":"7","DOI":"10.1186\/s13008-018-0040-6","article-title":"The functional diversity of Aurora kinases: a comprehensive review","volume":"13","author":"Willems","year":"2018","journal-title":"Cell Div"},{"key":"10.1016\/j.bioorg.2025.108480_bb0060","first-page":"825","article-title":"Disruption of the MYC transcriptional function by a small-molecule antagonist of MYC\/MAX dimerization","volume":"19","author":"Lu","year":"2008","journal-title":"Oncol. Rep."},{"key":"10.1016\/j.bioorg.2025.108480_bb0065","doi-asserted-by":"crossref","first-page":"2025","DOI":"10.1042\/BCJ20170771","article-title":"The multifaceted allosteric regulation of Aurora kinase a","volume":"475","author":"Levinson","year":"2018","journal-title":"Biochem. J."},{"key":"10.1016\/j.bioorg.2025.108480_bb0070","doi-asserted-by":"crossref","first-page":"851","DOI":"10.1016\/S1097-2765(03)00392-7","article-title":"Structural basis of Aurora-a activation by TPX2 at the mitotic spindle","volume":"12","author":"Bayliss","year":"2003","journal-title":"Mol. Cell"},{"key":"10.1016\/j.bioorg.2025.108480_bb0075","doi-asserted-by":"crossref","first-page":"691","DOI":"10.1016\/S0960-9822(03)00166-0","article-title":"A novel mechanism for activation of the protein kinase Aurora a","volume":"13","author":"Eyers","year":"2003","journal-title":"Curr. Biol."},{"key":"10.1016\/j.bioorg.2025.108480_bb0080","first-page":"600","article-title":"YaTCM: yet another traditional Chinese medicine database for drug discovery, Comput Struct","volume":"16","author":"Li","year":"2018","journal-title":"Biotechnol. J."},{"key":"10.1016\/j.bioorg.2025.108480_bb0085","doi-asserted-by":"crossref","first-page":"1067","DOI":"10.1093\/bioinformatics\/bty707","article-title":"Tang, admetSAR 2.0: web-service for prediction and optimization of chemical ADMET properties","volume":"35","author":"Yang","year":"2019","journal-title":"Bioinformatics"},{"key":"10.1016\/j.bioorg.2025.108480_bb0090","doi-asserted-by":"crossref","first-page":"414","DOI":"10.1016\/j.ccr.2014.07.015","article-title":"Drugging MYCN through an allosteric transition in Aurora kinase a","volume":"26","author":"Gustafson","year":"2014","journal-title":"Cancer Cell"},{"key":"10.1016\/j.bioorg.2025.108480_bb0095","doi-asserted-by":"crossref","first-page":"67","DOI":"10.1016\/j.ccr.2008.12.005","article-title":"Stabilization of N-Myc is a critical function of Aurora a in human neuroblastoma","volume":"15","author":"Otto","year":"2009","journal-title":"Cancer Cell"},{"key":"10.1016\/j.bioorg.2025.108480_bb0100","doi-asserted-by":"crossref","first-page":"15","DOI":"10.1186\/s12943-020-01305-3","article-title":"Targeting AURKA in Cancer: molecular mechanisms and opportunities for Cancer therapy","volume":"20","author":"Du","year":"2021","journal-title":"Mol. Cancer"},{"key":"10.1016\/j.bioorg.2025.108480_bb0105","doi-asserted-by":"crossref","first-page":"773","DOI":"10.1248\/bpb.b22-00637","article-title":"Brazilin inhibits the invasion and metastasis of breast Cancer","volume":"46","author":"Yang","year":"2023","journal-title":"Biol. Pharm. Bull."},{"key":"10.1016\/j.bioorg.2025.108480_bb0110","doi-asserted-by":"crossref","first-page":"375","DOI":"10.15171\/apb.2017.045","article-title":"Two active compounds from Caesalpinia sappan L. in Combination with Cisplatin Synergistically Induce Apoptosis and Cell Cycle Arrest on WiDr Cells","volume":"7","author":"Handayani","year":"2017","journal-title":"Adv Pharm Bull"},{"key":"10.1016\/j.bioorg.2025.108480_bb0115","doi-asserted-by":"crossref","first-page":"1337","DOI":"10.31557\/APJCP.2022.23.4.1337","article-title":"Brazilin isolated from Caesalpina Sappan wood induces intrinsic apoptosis on A549 Cancer cell line by increasing p53, caspase-9, and caspase-3","volume":"23","author":"Suyatmi","year":"2022","journal-title":"Asian Pac. J. Cancer Prev."}],"container-title":["Bioorganic Chemistry"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0045206825003608?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0045206825003608?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2025,11,4]],"date-time":"2025-11-04T02:23:53Z","timestamp":1762223033000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S0045206825003608"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2025,6]]},"references-count":23,"alternative-id":["S0045206825003608"],"URL":"https:\/\/doi.org\/10.1016\/j.bioorg.2025.108480","relation":{},"ISSN":["0045-2068"],"issn-type":[{"value":"0045-2068","type":"print"}],"subject":[],"published":{"date-parts":[[2025,6]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"Identification of novel AURKA inhibitors against neuroblastoma using a virtual screening approach","name":"articletitle","label":"Article Title"},{"value":"Bioorganic Chemistry","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.bioorg.2025.108480","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2025 Elsevier Inc. All rights are reserved, including those for text and data mining, AI training, and similar technologies.","name":"copyright","label":"Copyright"}],"article-number":"108480"}}