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核磁共振代谢组学与随机森林模型用于识别冠心病患者血瘀证潜在血浆生物标志物

NMR Metabolomics and Random Forests Models to Identify Potential Plasma Biomarkers of Blood Stasis Syndrome With Coronary Heart Disease Patients.

作者信息

Zhao Lin-Lin, Qiu Xin-Jian, Wang Wen-Bo, Li Ruo-Meng, Wang Dong-Sheng

机构信息

Health Management Department, The Third Xiangya Hospital, Central South University, Changsha, China.

Institute of Integrated Traditional Chinese and Western Medicine, Xiangya Hospital, Central South University, Changsha, China.

出版信息

Front Physiol. 2019 Sep 4;10:1109. doi: 10.3389/fphys.2019.01109. eCollection 2019.

Abstract

BACKGROUND

Coronary heart disease (CHD) remains highly prevalent and is one of the largest causes of death worldwide. Blood stasis syndrome (BSS) is the main syndrome associated with CHD. However, the underlying biological basis of BSS with CHD is not yet been fully understood.

MATERIALS AND METHODS

We proposed a metabolomics method based on H-NMR and random forest (RF) models to elucidate the underlying biological basis of BSS with CHD. Firstly, 58 cases of CHD patients, including 27 BSS and 31 phlegm syndrome (PS), and 26 volunteers were recruited from Xiangya Hospital affiliated to Central South University. A 1 mL venous blood sample was collected for NMR analysis. Secondly, principal component analysis (PCA), partial least squares discrimination analysis (PLS-DA) and RF was applied to observe the classification of each group, respectively. Finally, RF and multidimensional scaling (MDS) were utilized to discover the plasma potential biomarkers in CHD patients and CHD-BSS patients.

RESULTS

The models constructed by RF could visually discriminate BSS from PS in CHD patients. Simultaneously, we obtained 12 characteristic metabolites, including lysine, glutamine, taurine, tyrosine, phenylalanine, histidine, lipid, citrate, choline, lactate, α-glucose, β-glucose related to the CHD patients, and Choline, β-glucose, α-glucose and tyrosine were considered as potential biomarkers of CHD-BSS.

CONCLUSION

The combining of H-NMR profiling with RF models was a useful approach to analyze complex metabolomics data (should be deleted). Choline, β-glucose, α-glucose and tyrosine were considered as potential biomarkers of CHD-BSS.

摘要

背景

冠心病(CHD)仍然非常普遍,是全球最大的死亡原因之一。血瘀证(BSS)是与冠心病相关的主要证型。然而,冠心病血瘀证的潜在生物学基础尚未完全明确。

材料与方法

我们提出了一种基于氢核磁共振(H-NMR)和随机森林(RF)模型的代谢组学方法,以阐明冠心病血瘀证的潜在生物学基础。首先,从中南大学湘雅医院招募了58例冠心病患者,其中包括27例血瘀证患者和31例痰证患者,以及26名志愿者。采集1 mL静脉血样进行核磁共振分析。其次,分别应用主成分分析(PCA)、偏最小二乘判别分析(PLS-DA)和随机森林方法观察各组的分类情况。最后,利用随机森林和多维标度法(MDS)发现冠心病患者和冠心病血瘀证患者血浆中的潜在生物标志物。

结果

随机森林构建的模型能够直观地区分冠心病患者中的血瘀证和痰证。同时,我们获得了12种特征代谢物,包括赖氨酸、谷氨酰胺、牛磺酸、酪氨酸、苯丙氨酸、组氨酸、脂质、柠檬酸、胆碱、乳酸、α-葡萄糖、β-葡萄糖与冠心病患者相关,胆碱、β-葡萄糖、α-葡萄糖和酪氨酸被认为是冠心病血瘀证的潜在生物标志物。

结论

氢核磁共振图谱与随机森林模型相结合是分析复杂代谢组学数据的有效方法。胆碱、β-葡萄糖、α-葡萄糖和酪氨酸被认为是冠心病血瘀证的潜在生物标志物。

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