Yuao Zeng,Lamei Liu,Danyang Xiong,Zheng Wan,Zedong Bi,Xian Zeng,Xian Wei,Xiao He
{"title":"预测ncrna -蛋白相互作用的迁移学习。","authors":"Yuao Zeng,Lamei Liu,Danyang Xiong,Zheng Wan,Zedong Bi,Xian Zeng,Xian Wei,Xiao He","doi":"10.1021/acs.jcim.5c00914","DOIUrl":null,"url":null,"abstract":"Noncoding RNAs (ncRNAs) interact with proteins, playing a crucial role in regulating gene expression and cellular functions. Accurate prediction of these interactions is essential for understanding biological processes and developing novel therapeutic agents. However, identifying ncRNA-protein interactions (ncRPI) through experimental methods is often costly and time-consuming. Although numerous machine learning and deep learning approaches have been developed for ncRPI prediction, their accuracy is often limited by the small size of available data sets. To address this challenge, we present Transfer-RPI, a transfer learning-based framework designed to enhance generalization and improve prediction performance through deep feature learning. Transfer-RPI leverages the RiNALMo and ESM models to extract comprehensive features from RNA and protein sequences, respectively. By integrating these rich and informative feature sets, Transfer-RPI fine-tunes the embedded complex interaction patterns, thereby enhancing performance even when trained on small data sets. Our results demonstrate that deep learning architectures augmented with intricate feature representations and transfer learning significantly boost prediction accuracy. Under 5-fold cross-validation, Transfer-RPI outperforms existing methods, achieving accuracies of 80.1, 89.3, 94.3, 94.4, and 95.4% on the RPI369, RPI488, RPI1807, RPI2241, and NPInter v2.0 data sets, respectively. These findings highlight the potential of transfer learning to overcome data limitations and enhance prediction performance. By harnessing advanced feature representations, Transfer-RPI offers a powerful tool for uncovering ncRPI, paving the way for deeper insights into molecular biology and novel therapeutic innovations.","PeriodicalId":44,"journal":{"name":"Journal of Chemical Information and Modeling ","volume":"12 1","pages":""},"PeriodicalIF":5.6000,"publicationDate":"2025-07-18","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Transfer Learning for Predicting ncRNA-Protein Interactions.\",\"authors\":\"Yuao Zeng,Lamei Liu,Danyang Xiong,Zheng Wan,Zedong Bi,Xian Zeng,Xian Wei,Xiao He\",\"doi\":\"10.1021/acs.jcim.5c00914\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"Noncoding RNAs (ncRNAs) interact with proteins, playing a crucial role in regulating gene expression and cellular functions. Accurate prediction of these interactions is essential for understanding biological processes and developing novel therapeutic agents. However, identifying ncRNA-protein interactions (ncRPI) through experimental methods is often costly and time-consuming. Although numerous machine learning and deep learning approaches have been developed for ncRPI prediction, their accuracy is often limited by the small size of available data sets. To address this challenge, we present Transfer-RPI, a transfer learning-based framework designed to enhance generalization and improve prediction performance through deep feature learning. Transfer-RPI leverages the RiNALMo and ESM models to extract comprehensive features from RNA and protein sequences, respectively. By integrating these rich and informative feature sets, Transfer-RPI fine-tunes the embedded complex interaction patterns, thereby enhancing performance even when trained on small data sets. Our results demonstrate that deep learning architectures augmented with intricate feature representations and transfer learning significantly boost prediction accuracy. Under 5-fold cross-validation, Transfer-RPI outperforms existing methods, achieving accuracies of 80.1, 89.3, 94.3, 94.4, and 95.4% on the RPI369, RPI488, RPI1807, RPI2241, and NPInter v2.0 data sets, respectively. These findings highlight the potential of transfer learning to overcome data limitations and enhance prediction performance. 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Transfer Learning for Predicting ncRNA-Protein Interactions.
Noncoding RNAs (ncRNAs) interact with proteins, playing a crucial role in regulating gene expression and cellular functions. Accurate prediction of these interactions is essential for understanding biological processes and developing novel therapeutic agents. However, identifying ncRNA-protein interactions (ncRPI) through experimental methods is often costly and time-consuming. Although numerous machine learning and deep learning approaches have been developed for ncRPI prediction, their accuracy is often limited by the small size of available data sets. To address this challenge, we present Transfer-RPI, a transfer learning-based framework designed to enhance generalization and improve prediction performance through deep feature learning. Transfer-RPI leverages the RiNALMo and ESM models to extract comprehensive features from RNA and protein sequences, respectively. By integrating these rich and informative feature sets, Transfer-RPI fine-tunes the embedded complex interaction patterns, thereby enhancing performance even when trained on small data sets. Our results demonstrate that deep learning architectures augmented with intricate feature representations and transfer learning significantly boost prediction accuracy. Under 5-fold cross-validation, Transfer-RPI outperforms existing methods, achieving accuracies of 80.1, 89.3, 94.3, 94.4, and 95.4% on the RPI369, RPI488, RPI1807, RPI2241, and NPInter v2.0 data sets, respectively. These findings highlight the potential of transfer learning to overcome data limitations and enhance prediction performance. By harnessing advanced feature representations, Transfer-RPI offers a powerful tool for uncovering ncRPI, paving the way for deeper insights into molecular biology and novel therapeutic innovations.
期刊介绍:
The Journal of Chemical Information and Modeling publishes papers reporting new methodology and/or important applications in the fields of chemical informatics and molecular modeling. Specific topics include the representation and computer-based searching of chemical databases, molecular modeling, computer-aided molecular design of new materials, catalysts, or ligands, development of new computational methods or efficient algorithms for chemical software, and biopharmaceutical chemistry including analyses of biological activity and other issues related to drug discovery.
Astute chemists, computer scientists, and information specialists look to this monthly’s insightful research studies, programming innovations, and software reviews to keep current with advances in this integral, multidisciplinary field.
As a subscriber you’ll stay abreast of database search systems, use of graph theory in chemical problems, substructure search systems, pattern recognition and clustering, analysis of chemical and physical data, molecular modeling, graphics and natural language interfaces, bibliometric and citation analysis, and synthesis design and reactions databases.