Profiling of Potential Anti-Diabetic Active Compounds in White Tea: An Integrated Study of Polyphenol-Targeted Metabolomics, Network Pharmacology, and Computer Simulation (2024)

多酚代谢组学药理学仿形（计算机编程）计算生物学活性化合物传统医学化学医学生物信息学生物生物化学计算机科学组合化学抗氧化剂操作系统

作者

Weiwei Wu,Zhiqiang Zheng,Zhi‐Hui Wang,Chenxi Gao,Yilin Liang,Wen Zeng,Weijiang Sun

出处

期刊：Foods [MDPI AG]
日期：2024-10-22 卷期号：13 (21): 3354-3354

链接

doi.orgdoi.org

标识

DOI：10.3390/foods13213354

摘要

Diabetes remains a critical global public health challenge, posing a growing threat to human health and well-being. White tea is a lightly fermented tea and one of the six traditional tea categories in China. Owing to its rich content of bioactive compounds such as catechins and alkaloids, it has demonstrated potential anti-diabetic properties. However, its precise bioactive components, mechanisms of action, and relevant molecular targets require further investigation. In this study, an integrated approach combining polyphenol-targeted metabolomics, in vitro antioxidant assays, α-glucosidase inhibition tests, network pharmacology analysis, GEO database exploration, molecular docking, and molecular dynamics simulations was employed to identify the potential anti-diabetic compounds, targets, and mechanisms of white tea. The findings revealed that white tea is particularly abundant in 10 bioactive compounds, including epigallocatechin gallate, epicatechin gallate, and catechin, all of which exhibit significant anti-diabetic potential. These compounds were found to exert their effects by interacting with core molecular targets, namely cathepsin V (CTSV) and nucleotide-binding oligomerization domain-containing protein 1 (NOD1), and engaging in pathways related to signal transduction, apoptosis, and immune responses. This study establishes a strong theoretical basis for advancing white tea research and underscores new opportunities for applying natural products in diabetes therapy.

求助该文献

最长约 10秒，即可获得该文献文件

相关文献

科研通AI机器人已完成分析

对不起，本页面需要您登录以后才可查看

进入登录/注册页面

") }else{ var paper_html = ''; for (var i=0;i

'; var this_paper = related_papers[i]; paper_html += '

'+this_paper['title']+'

'; if (this_paper['authors']){ paper_html += '

'+ this_paper['authors'].join(", ")+'

'; } journal_html = ''; if (this_paper['journal']){ journal_html += ''+this_paper['journal']+''; } if (this_paper['publication_date']){ journal_html += ''+(this_paper['publication_date'].substring(0, 4))+''; } var biblio_html = ''; var biblio = this_paper['biblio']; if (biblio[0]){ biblio_html += biblio[0]; } if (biblio[1]){ biblio_html += " (" + biblio[1] + ")"; } if (biblio[2] || biblio[3]){ biblio_html += ": " + biblio[2] + "-" + biblio[3]; } if (biblio_html){ journal_html += ''+biblio_html+''; } if (this_paper['cited_by_count']){ journal_html += '被引量：'+this_paper['cited_by_count']+''; } paper_html += '

' + journal_html + '

'; var ids_html = ''; if (this_paper['doi']){ ids_html += "DOI：" +this_paper['doi']+""; } if (this_paper['ids']){ ids_html += "PMID：" +this_paper['ids']+ ""; } if (ids_html){ paper_html += '

'+ids_html+'

'; } if (i!=related_papers.length-1){ paper_html += ''; } paper_html += ''; } var old_html = $('.paper-related-content').html(); $('.paper-related-content').html(""); if (typeof old_html === 'string' && old_html.includes('科研通AI机器人正在分析抓取中')){ $('.paper-related-content ol').slideDown(); }else{ $('.paper-related-content ol').show(); } } } var old_html = $('.paper-related-content').html(); if (typeof old_html === 'string' && old_html.includes('科研通AI机器人正在分析抓取中')){ $.ajax({ type: 'POST', async: true, //表示请求是否异步处理 dataType: "json",//返回的数据类型 url: "/scholar/get-related-papers", data: { '_csrf': '_NCSnK29i82je6EnOfBiEkUBqJ2bXijKyEpc7txZW_u7tvfOyfzehPMi1GhphzNNNkfC7s4xeqanfimatTgxgQ==', 'id':"3eLJ6LdMr", 't':new Date().getTime() }, error: function (data) { $(".get-related-paper-status").html('对不起，发生错误，请请稍候再试
如果长期遇到该问题，请通过底部客服中心反馈，谢谢') }, success: function (res) { if (res.code == 0) { //提交成功 render_related_papers(res.data); } else if (res.code == 1) { //出错 $(".get-related-paper-status").html('对不起，发生错误
错误提示：'+res.msg+'如果长期遇到该问题，请通过底部客服中心反馈，谢谢') } else { $(".get-related-paper-status").html('对不起，发生未知错误，请请稍候再试
如果长期遇到该问题，请通过底部客服中心反馈，谢谢') } } }); }else{ } return false; });

科研通智能强力驱动
Strongly Powered by AbleSci AI

我的文献求助列表浏览历史

一分钟了解求助规则 | 捐赠本站 | 历史今天

今日热心研友

带头大哥 20 4830

嗯哼 110 2140

坚强的广山 2200

shinysparrow 2050

rosalieshi 41 1370

愉快的真 34 1190

Singularity 64 880

iNk 73 760

薰硝壤 1400

pluto 42 790

HEIKU 44 730

Xxing 48 670

寻道图强 32 820

Frank 990

不配. 29 630

热心市民小红花 820

谨慎的映寒 800

art888 800

CWNU_HAN 20 470

tuanheqi 620

注：热心度 = 本日应助数 + 本日被采纳获取积分÷10

说明：该算法综合考虑我应助的数量和质量。但存在一定的滞后性，可能今天的应助到明天才被采纳，那这一部分的积分就要算到明天的排名中。

'; layer.open({ type: 0 ,shade: 0.1 ,btn:['关闭'] ,title: '排名介绍' ,content: html_content }); }); $('.hot-assisters .fly-panel-title a').bind('click',function () { $('.hot-assisters .fly-panel-title a').removeClass('layui-this'); $(this).addClass('layui-this'); var type = 'today'; $('.hot-assisters-item').hide(); if ($(this).hasClass('hot-today')){ type = 'today'; }else if ($(this).hasClass('hot-all')){ type = 'all'; }else if ($(this).hasClass('hot-week')){ type = 'week'; }else if ($(this).hasClass('hot-yesterday')){ type = 'yesterday'; }else if ($(this).hasClass('hot-month')){ type = 'month'; } $('.hot-assisters-' + type).show(); if (type != 'today' ){ if (($('.hot-assisters-'+type).html()).trim()==''){ $('.hot-assisters-'+type) .html('

正在获取，请稍候

'); $.ajax({ type: 'POST', async: true, //表示请求是否异步处理 dataType: "json",//返回的数据类型 url: "https://www.ablesci.com/user/hot-assisters", data:{ '_csrf': '_NCSnK29i82je6EnOfBiEkUBqJ2bXijKyEpc7txZW_u7tvfOyfzehPMi1GhphzNNNkfC7s4xeqanfimatTgxgQ==', 'type':type }, error: function (data) { $('.hot-assisters-'+type) .html('

对不起，发生错误

'); }, success: function (res) { if (res.code == 0) { //提交成功 var html_str = '

'; for (i=0;i<(res.data).length;i++){ html_str = html_str + "

" + (res.data[i].online==true?'':"") + ""+ "" + "" + res.data[i].nickname + "" + res.data[i].c + "次应助" + "" + "

"; } html_str = html_str + '

'; $('.hot-assisters-'+type).html(html_str); } else if (res.code == 1) { $('.hot-assisters-'+type) .html('

'+res.msg+'

'); } else { $('.hot-assisters-'+type) .html('

对不起，发生未知错误

'); } } }); } } }) })