{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,19]],"date-time":"2026-10-19T20:15:18Z","timestamp":1792440918069,"version":"4.5.0"},"reference-count":41,"publisher":"Wiley","issue":"2","license":[{"start":{"date-parts":[[2021,6,7]],"date-time":"2021-06-07T00:00:00Z","timestamp":1623024000000},"content-version":"vor","delay-in-days":0,"URL":"http:\/\/onlinelibrary.wiley.com\/termsAndConditions#vor"}],"funder":[{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["81803433"],"award-info":[{"award-number":["81803433"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["onlinelibrary.wiley.com"],"crossmark-restriction":true},"short-container-title":["Chem Biol Drug Des"],"published-print":{"date-parts":[[2021,8]]},"abstract":"<jats:title>Abstract<\/jats:title><jats:p>Drug\u2010induced ototoxicity has become a serious global problem, because of leading to deafness in hundreds of thousands of people every year. It always results from exposure to drugs or environmental chemicals that cause the impairment and degeneration of the inner ear. Herein, we focused on the in silico modeling of drug\u2010induced ototoxicity of chemicals. We collected 1,102 ototoxic medications and 1,705 non\u2010ototoxic drugs. Based on the data set, a series of computational models were developed with different traditional machine learning and deep learning algorithms implemented on an online chemical database and modeling environment. Six ML models performed best on 5\u2010fold cross\u2010validation and test set. A consensus model was developed with the best individual models. These models were further validated with an external validation. The consensus model showed best predictive ability, with high accuracy of 0.95 on test set and 0.90 on validation set. The consensus model and the data sets used for model development are available at <jats:ext-link xmlns:xlink=\"http:\/\/www.w3.org\/1999\/xlink\" xlink:href=\"https:\/\/ochem.eu\/model\/46566321\">https:\/\/ochem.eu\/model\/46566321<\/jats:ext-link>. Besides, 16 structural alerts responsible for drug\u2010induced ototoxicity were identified. We hope the results could provide meaningful knowledge and useful tools for ototoxicity evaluation in drug discovery and environmental risk assessment.<\/jats:p>","DOI":"10.1111\/cbdd.13894","type":"journal-article","created":{"date-parts":[[2021,5,20]],"date-time":"2021-05-20T03:15:30Z","timestamp":1621480530000},"page":"248-257","update-policy":"https:\/\/doi.org\/10.1002\/crossmark_policy","source":"Crossref","is-referenced-by-count":30,"title":["In silico prediction of drug\u2010induced ototoxicity using machine learning and deep learning methods"],"prefix":"10.1111","volume":"98","author":[{"given":"Xin","family":"Huang","sequence":"first","affiliation":[{"name":"Department of Clinical Pharmacy The First Affiliated Hospital of Shandong First Medical University &amp; Shandong Provincial Qianfoshan Hospital Jinan China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Fang","family":"Tang","sequence":"additional","affiliation":[{"name":"Center for Big Data Research in Health and Medicine The First Affiliated Hospital of Shandong First Medical University &amp; Shandong Provincial Qianfoshan Hospital Jinan China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Yuqing","family":"Hua","sequence":"additional","affiliation":[{"name":"Department of Clinical Pharmacy The First Affiliated Hospital of Shandong First Medical University &amp; Shandong Provincial Qianfoshan Hospital Jinan China"},{"name":"School of Pharmacy Shandong First Medical University (Shandong Academy of Medical Science) Taian China"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-1148-9898","authenticated-orcid":false,"given":"Xiao","family":"Li","sequence":"additional","affiliation":[{"name":"Department of Clinical Pharmacy The First Affiliated Hospital of Shandong First Medical University &amp; Shandong Provincial Qianfoshan Hospital Jinan China"},{"name":"Department of Clinical Pharmacy Shandong Provincial Qianfoshan Hospital Shandong University Jinan China"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"311","published-online":{"date-parts":[[2021,6,7]]},"reference":[{"key":"e_1_2_7_2_1","doi-asserted-by":"publisher","DOI":"10.1016\/j.heliyon.2018.e00938"},{"key":"e_1_2_7_3_1","doi-asserted-by":"publisher","DOI":"10.1111\/j.1749\u20106632.1999.tb00277.x"},{"key":"e_1_2_7_4_1","doi-asserted-by":"publisher","DOI":"10.1002\/em.2860070613"},{"key":"e_1_2_7_5_1","volume-title":"Prescription medications, drugs, herbs & chemicals associated with tinnitus","author":"ATA","year":"2017"},{"key":"e_1_2_7_6_1","volume-title":"Ototoxic drugs exposed: The shocking truth about prescription drugs, medications, chemicals and herbals that can (and do) damage our ears","author":"Bauman N. 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