Machine-learning models utilizing CYP3A4*1G show improved prediction of hypoglycemic medication in Type 2 diabetes.

IF 16.4 1区 化学 Q1 CHEMISTRY, MULTIDISCIPLINARY
Yi Yang, Xing-Yun Hou, Weiqing Ge, Xinye Wang, Yitian Xu, Wansheng Chen, Yaping Tian, Huafang Gao, Qian Chen
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引用次数: 1

Abstract

The effectiveness and side effects of Type 2 diabetes (T2D) medication are related to individual genetic background. SNPs CYP3A4 and CYP2C19 were introduced to machine-learning models to improve the performance of T2D medication prediction. Two multilabel classification models, ML-KNN and WRank-SVM, trained with clinical data and CYP3A4/CYP2C19 SNPs were evaluated. Prediction performance was evaluated with Hamming loss, one-error, coverage, ranking loss and average precision. The average precision of ML-KNN and WRank-SVM using clinical data was 92.74% and 92.9%, respectively. Combined with CYP2C19*2*3, the average precision dropped to 88.84% and 89.93%, respectively. While combined with CYP3A4*1G, the average precision was enhanced to 97.96% and 97.82%, respectively. Results suggest that CYP3A4*1G can improve the performance of ML-KNN and WRank-SVM models in predicting T2D medication performance.

利用CYP3A4*1G的机器学习模型显示,对2型糖尿病患者降糖药物的预测有所改善。
2型糖尿病(T2D)药物治疗的有效性和副作用与个体遗传背景有关。将snp CYP3A4和CYP2C19引入机器学习模型,以提高T2D药物预测的性能。对临床数据和CYP3A4/CYP2C19 snp训练的ML-KNN和WRank-SVM两种多标签分类模型进行评价。用汉明损失、单误差、覆盖率、排序损失和平均精度评价预测性能。ML-KNN和rank - svm对临床数据的平均准确率分别为92.74%和92.9%。结合CYP2C19*2*3,平均精密度分别降至88.84%和89.93%。与CYP3A4*1G联合使用时,平均精密度分别提高到97.96%和97.82%。结果表明CYP3A4*1G可提高ML-KNN和WRank-SVM模型预测T2D用药效果的性能。
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来源期刊
Accounts of Chemical Research
Accounts of Chemical Research 化学-化学综合
CiteScore
31.40
自引率
1.10%
发文量
312
审稿时长
2 months
期刊介绍: Accounts of Chemical Research presents short, concise and critical articles offering easy-to-read overviews of basic research and applications in all areas of chemistry and biochemistry. These short reviews focus on research from the author’s own laboratory and are designed to teach the reader about a research project. In addition, Accounts of Chemical Research publishes commentaries that give an informed opinion on a current research problem. Special Issues online are devoted to a single topic of unusual activity and significance. Accounts of Chemical Research replaces the traditional article abstract with an article "Conspectus." These entries synopsize the research affording the reader a closer look at the content and significance of an article. Through this provision of a more detailed description of the article contents, the Conspectus enhances the article's discoverability by search engines and the exposure for the research.
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