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抗高血压肽预测器:一个基于机器学习的网络服务器,用于预测具有潜在血管紧张素转换酶抑制活性的食物来源肽。

Anti-hypertensive Peptide Predictor: A Machine Learning-Empowered Web Server for Prediction of Food-Derived Peptides with Potential Angiotensin-Converting Enzyme-I Inhibitory Activity.

机构信息

Department of Biosciences and Bioengineering, Indian Institute of Technology Roorkee, Roorkee 247667, India.

Department of Electrical Engineering, Indian Institute of Technology Roorkee, Roorkee 247667, India.

出版信息

J Agric Food Chem. 2021 Dec 15;69(49):14995-15004. doi: 10.1021/acs.jafc.1c04555. Epub 2021 Dec 2.

Abstract

Angiotensin converting enzyme-I (ACE-I) is a key therapeutic target of the renin-angiotensin-aldosterone system (RAAS), the central pathway of blood pressure regulation. Food-derived peptides with ACE-I inhibitory activities are receiving significant research attention. However, identification of ACE-I inhibitory peptides from different food proteins is a labor-intensive, lengthy, and expensive process. For successful identification of potential ACE-I inhibitory peptides from food sources, a machine learning and structural bioinformatics-based web server has been developed and reported in this study. The web server can take input in the FASTA format or through UniProt ID to perform the gastrointestinal digestion and then screen the resulting peptides for ACE-I inhibitory activity. This unique platform provides elaborated structural and functional features of the active peptides and their interaction with ACE-I. Thus, it can potentially enhance the efficacy and reduce the time and cost in identifying and characterizing novel ACE-I inhibitory peptides from food proteins. URL: http://hazralab.iitr.ac.in/ahpp/index.php.

摘要

血管紧张素转换酶-I(ACE-I)是肾素-血管紧张素-醛固酮系统(RAAS)的关键治疗靶点,是血压调节的中心途径。具有 ACE-I 抑制活性的食物衍生肽受到了广泛关注。然而,从不同的食物蛋白中鉴定 ACE-I 抑制肽是一个劳动密集型、漫长而昂贵的过程。为了成功地从食物来源中鉴定潜在的 ACE-I 抑制肽,本研究开发并报道了一种基于机器学习和结构生物信息学的网络服务器。该网络服务器可以接受 FASTA 格式的输入或通过 UniProt ID 进行胃肠消化,然后筛选具有 ACE-I 抑制活性的肽。该独特的平台提供了活性肽的详细结构和功能特征及其与 ACE-I 的相互作用。因此,它有可能提高鉴定和表征食物蛋白中新型 ACE-I 抑制肽的功效,并降低时间和成本。网址:http://hazralab.iitr.ac.in/ahpp/index.php。

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