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基于文献的新药适应症预测:考虑实体之间的关系

Literature-based prediction of novel drug indications considering relationships between entities.

作者信息

Jang Giup, Lee Taekeon, Lee Byung Mun, Yoon Youngmi

机构信息

Dept. of IT Convergence Engineering, Gachon University, Korea.

出版信息

Mol Biosyst. 2017 Jun 27;13(7):1399-1405. doi: 10.1039/c7mb00020k.

DOI:10.1039/c7mb00020k
PMID:28581007
Abstract

There have been many attempts to identify and develop new uses for existing drugs, which is known as drug repositioning. Among these efforts, text mining is an effective means of discovering novel knowledge from a large amount of literature data. We identify a gene regulation by a drug and a phenotype based on the biomedical literature. Drugs or phenotypes can activate or inhibit gene regulation. We calculate the therapeutic possibility that a drug acts on a phenotype by means of these two types of regulation. We assume that a drug treats a phenotype if the genes regulated by the phenotype are inversely correlated with the genes regulated by the drug. Based on this hypothesis, we identify drug-phenotype associations with therapeutic possibility. To validate the drug-phenotype associations predicted by our method, we make an enrichment comparison with known drug-phenotype associations. We also identify candidate drugs for drug repositioning from novel associations and thus reveal that our method is a novel approach to drug repositioning.

摘要

人们已经进行了许多尝试来识别和开发现有药物的新用途,这被称为药物重新定位。在这些努力中,文本挖掘是从大量文献数据中发现新知识的有效手段。我们基于生物医学文献确定药物对基因的调控以及一种表型。药物或表型可以激活或抑制基因调控。我们通过这两种调控方式计算药物作用于一种表型的治疗可能性。我们假设,如果由该表型调控的基因与由药物调控的基因呈负相关,那么该药物可治疗此表型。基于这一假设,我们确定具有治疗可能性的药物 - 表型关联。为了验证我们的方法预测的药物 - 表型关联,我们与已知的药物 - 表型关联进行富集比较。我们还从新关联中识别出用于药物重新定位的候选药物,从而表明我们的方法是一种药物重新定位的新方法。

相似文献

1
Literature-based prediction of novel drug indications considering relationships between entities.基于文献的新药适应症预测:考虑实体之间的关系
Mol Biosyst. 2017 Jun 27;13(7):1399-1405. doi: 10.1039/c7mb00020k.
2
PISTON: Predicting drug indications and side effects using topic modeling and natural language processing.PISTON:使用主题建模和自然语言处理预测药物适应证和副作用。
J Biomed Inform. 2018 Nov;87:96-107. doi: 10.1016/j.jbi.2018.09.015. Epub 2018 Sep 27.
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Inferring new drug indications using the complementarity between clinical disease signatures and drug effects.利用临床疾病特征与药物效应之间的互补性推断新药适应症。
J Biomed Inform. 2016 Feb;59:248-57. doi: 10.1016/j.jbi.2015.12.003. Epub 2015 Dec 17.
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DrPOCS: Drug Repositioning Based on Projection Onto Convex Sets.DrPOCS:基于凸集投影的药物重定位。
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Prediction of drug gene associations via ontological profile similarity with application to drug repositioning.通过本体特征相似性预测药物-基因关联及其在药物重新定位中的应用
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A phenome-guided drug repositioning through a latent variable model.基于潜在变量模型的表型导向药物重定位。
BMC Bioinformatics. 2014 Aug 8;15(1):267. doi: 10.1186/1471-2105-15-267.
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DMAP: a connectivity map database to enable identification of novel drug repositioning candidates.DMAP:一个用于识别新型药物重新定位候选药物的连接性图谱数据库。
BMC Bioinformatics. 2015;16 Suppl 13(Suppl 13):S4. doi: 10.1186/1471-2105-16-S13-S4. Epub 2015 Sep 25.
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Mining drug-disease relationships as a complement to medical genetics-based drug repositioning: Where a recommendation system meets genome-wide association studies.挖掘药物-疾病关系,作为基于医学遗传学的药物再定位的补充:推荐系统与全基因组关联研究的结合。
Clin Pharmacol Ther. 2015 May;97(5):451-4. doi: 10.1002/cpt.82. Epub 2015 Apr 3.
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Drug repositioning in SLE: crowd-sourcing, literature-mining and Big Data analysis.系统性红斑狼疮中的药物重新定位:众包、文献挖掘与大数据分析。
Lupus. 2016 Sep;25(10):1150-70. doi: 10.1177/0961203316657437.
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MD-Miner: a network-based approach for personalized drug repositioning.MD-Miner:一种基于网络的个性化药物重新定位方法。
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引用本文的文献

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Computationally repurposing drugs for breast cancer subtypes using a network-based approach.基于网络的方法对乳腺癌亚型进行药物的重新定位。
BMC Bioinformatics. 2022 Apr 20;23(1):143. doi: 10.1186/s12859-022-04662-6.
2
Literature-Wide Association Studies (LWAS) for a Rare Disease: Drug Repurposing for Inflammatory Breast Cancer.针对罕见病的全文学术关联研究:炎性乳腺癌的药物再利用。
Molecules. 2020 Aug 28;25(17):3933. doi: 10.3390/molecules25173933.
3
Exploring the new horizons of drug repurposing: A vital tool for turning hard work into smart work.
探索药物再利用的新领域:将辛勤工作转化为聪明工作的重要工具。
Eur J Med Chem. 2019 Nov 15;182:111602. doi: 10.1016/j.ejmech.2019.111602. Epub 2019 Aug 8.
4
Review of Drug Repositioning Approaches and Resources.药物重定位方法和资源综述。
Int J Biol Sci. 2018 Jul 13;14(10):1232-1244. doi: 10.7150/ijbs.24612. eCollection 2018.
5
Drug Repositioning in the Mirror of Patenting: Surveying and Mining Uncharted Territory.专利视角下的药物重新定位:探索与挖掘未知领域
Front Pharmacol. 2017 Dec 15;8:927. doi: 10.3389/fphar.2017.00927. eCollection 2017.