OncoProExp:一个用于综合癌症蛋白质组学和磷蛋白质组学分析的交互式闪亮web应用程序。

IF 4.1 2区 生物学 Q2 BIOCHEMISTRY & MOLECULAR BIOLOGY
Computational and structural biotechnology journal Pub Date : 2025-09-06 eCollection Date: 2025-01-01 DOI:10.1016/j.csbj.2025.08.038
Edris Sharif Rahmani, Prakash Lingasamy, Soheila Khojand, Ankita Lawarde, Sergio Vela Moreno, Andres Salumets, Vijayachitra Modhukur
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引用次数: 0

摘要

基于质谱(MS)的蛋白质组学彻底改变了癌症研究,使大规模的蛋白质分析和翻译后修饰(PTMs)能够识别癌症信号通路中的关键变化。然而,缺乏全面的、用户友好的综合分析平台限制了有效的数据探索、生物标志物发现和转化见解。为了解决这个问题,我们开发了OncoProExp,这是一个基于shine的交互式web应用程序,用于深入的癌症蛋白质组学和磷蛋白质组学分析。OncoProExp为数据预处理、交互式可视化(PCA、分层聚类、热图、基因集富集分析(GSEA))和基因表达数据的功能注释提供了强大的工作流程。差异表达分析促进了生物标志物和治疗靶点的发现,而生存分析识别了其表达分层整体生存的蛋白质,泛癌症探索整合了临床蛋白质组学和磷蛋白质组学数据集。OncoProExp还结合了最先进的预测建模,包括支持向量机(svm)、随机森林和人工神经网络(ann),从蛋白质组学和磷蛋白质组学谱中对癌症类型进行分类。这些模型通过SHapley加性解释(SHAP)增强了可解释性。为了提高其翻译实用性,OncoProExp支持用户上传数据、蛋白蛋白相互作用、途径富集、药物相关性评估和临床注释分析。OncoProExp可通过Docker容器部署,确保灵活和可扩展地集成到各个服务器中。临床蛋白质组学肿瘤分析协会(CPTAC)的数据集证明了它的实用性。OncoProExp可在https://oncopro.cs.ut.ee/免费访问,无需登录要求,为转化性癌症研究提供全面的资源。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
OncoProExp: An interactive shiny web application for comprehensive cancer proteomics and phosphoproteomics analysis.

Cancer research has been revolutionized by mass spectrometry (MS)-based proteomics, enabling large-scale profiling of proteins and post-translational modifications (PTMs) to identify critical alterations in cancer signaling pathways. However, the lack of comprehensive, user-friendly platforms for integrative analysis limits efficient data exploration, biomarker discovery, and translational insights. To address this, we developed OncoProExp, a Shiny-based interactive web application for in-depth cancer proteomic and phosphoproteomic analyses. OncoProExp offers robust workflows for data preprocessing, interactive visualizations (PCA, hierarchical clustering, heatmaps, gene set enrichment analysis (GSEA)), and functional annotation of gene expression data. Differential expression analysis facilitates biomarker and therapeutic target discovery, while survival analysis identifies proteins whose expression stratifies overall survival, and pan-cancer exploration integrates clinical proteomic and phosphoproteomic datasets. OncoProExp also incorporates state-of-the-art predictive modeling, including Support Vector Machines (SVMs), Random Forests, and Artificial Neural Networks (ANNs) to classify cancer types from proteomic and phosphoproteomic profiles. These models were enhanced by SHapley Additive exPlanations (SHAP) for interpretability. To enhance its translational utility, OncoProExp supports user-uploaded data, protein-protein interactions, pathway enrichment, drug relevance evaluation, and clinical annotation analysis. OncoProExp is deployable via Docker containers, ensuring flexible and scalable integration into individual servers. Its utility has been demonstrated using Clinical Proteomic Tumor Analysis Consortium (CPTAC) datasets. OncoProExp is freely accessible at https://oncopro.cs.ut.ee/ without login requirements, offering a comprehensive resource for translational cancer research.

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来源期刊
Computational and structural biotechnology journal
Computational and structural biotechnology journal Biochemistry, Genetics and Molecular Biology-Biophysics
CiteScore
9.30
自引率
3.30%
发文量
540
审稿时长
6 weeks
期刊介绍: Computational and Structural Biotechnology Journal (CSBJ) is an online gold open access journal publishing research articles and reviews after full peer review. All articles are published, without barriers to access, immediately upon acceptance. The journal places a strong emphasis on functional and mechanistic understanding of how molecular components in a biological process work together through the application of computational methods. Structural data may provide such insights, but they are not a pre-requisite for publication in the journal. Specific areas of interest include, but are not limited to: Structure and function of proteins, nucleic acids and other macromolecules Structure and function of multi-component complexes Protein folding, processing and degradation Enzymology Computational and structural studies of plant systems Microbial Informatics Genomics Proteomics Metabolomics Algorithms and Hypothesis in Bioinformatics Mathematical and Theoretical Biology Computational Chemistry and Drug Discovery Microscopy and Molecular Imaging Nanotechnology Systems and Synthetic Biology
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