Investigation of Anticancer Peptides Derived from <i>Arca</i> Species Using In Silico Analysis

This study employed an integrated in silico approach to identify and characterize anticancer peptides (ACPs) derived from <i>Arca</i> species. Using a comprehensive bioinformatics pipeline (BIOPEP, ToxinPred, ProtParam, ChemDraw, SwissTargetPrediction, and I-TASSER), we screened hydrolyz...

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Main Authors: Jixu Wu, Xiuhua Zhang, Yuting Jin, Man Zhang, Rongmin Yu, Liyan Song, Fei Liu, Jianhua Zhu
Format: Article
Language:English
Published: MDPI AG 2025-04-01
Series:Molecules
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Online Access:https://www.mdpi.com/1420-3049/30/7/1640
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author Jixu Wu
Xiuhua Zhang
Yuting Jin
Man Zhang
Rongmin Yu
Liyan Song
Fei Liu
Jianhua Zhu
author_facet Jixu Wu
Xiuhua Zhang
Yuting Jin
Man Zhang
Rongmin Yu
Liyan Song
Fei Liu
Jianhua Zhu
author_sort Jixu Wu
collection DOAJ
description This study employed an integrated in silico approach to identify and characterize anticancer peptides (ACPs) derived from <i>Arca</i> species. Using a comprehensive bioinformatics pipeline (BIOPEP, ToxinPred, ProtParam, ChemDraw, SwissTargetPrediction, and I-TASSER), we screened hydrolyzed bioactive peptides from <i>Arca</i> species, identifying seventeen novel peptide candidates. Subsequent in vitro validation revealed three peptides (KW, WQIWYK, KGKWQIWYKSL) with significant anticancer activity, demonstrating both high biosafety and clinical potential. Our findings highlight <i>Arca</i> species proteins as a valuable source of therapeutic ACPs and establish bioinformatics as an efficient strategy for rapid discovery of bioactive peptides. This approach combines computational prediction with experimental validation, offering a robust framework for developing novel peptide-based therapeutics.
format Article
id doaj-art-9ff505903f554c5da7e0793a421a3709
institution DOAJ
issn 1420-3049
language English
publishDate 2025-04-01
publisher MDPI AG
record_format Article
series Molecules
spelling doaj-art-9ff505903f554c5da7e0793a421a37092025-08-20T03:03:24ZengMDPI AGMolecules1420-30492025-04-01307164010.3390/molecules30071640Investigation of Anticancer Peptides Derived from <i>Arca</i> Species Using In Silico AnalysisJixu Wu0Xiuhua Zhang1Yuting Jin2Man Zhang3Rongmin Yu4Liyan Song5Fei Liu6Jianhua Zhu7Biotechnological Institute of Chinese Materia Medica, Jinan University, Guangzhou 510632, ChinaShandong Engineering Research Center for Efficient Preparation and Application of Sugar and Sugar Complex, Shandong Academy of Pharmaceutical Science, Jinan 250101, ChinaBiotechnological Institute of Chinese Materia Medica, Jinan University, Guangzhou 510632, ChinaBiotechnological Institute of Chinese Materia Medica, Jinan University, Guangzhou 510632, ChinaBiotechnological Institute of Chinese Materia Medica, Jinan University, Guangzhou 510632, ChinaBiotechnological Institute of Chinese Materia Medica, Jinan University, Guangzhou 510632, ChinaShandong Engineering Research Center for Efficient Preparation and Application of Sugar and Sugar Complex, Shandong Academy of Pharmaceutical Science, Jinan 250101, ChinaBiotechnological Institute of Chinese Materia Medica, Jinan University, Guangzhou 510632, ChinaThis study employed an integrated in silico approach to identify and characterize anticancer peptides (ACPs) derived from <i>Arca</i> species. Using a comprehensive bioinformatics pipeline (BIOPEP, ToxinPred, ProtParam, ChemDraw, SwissTargetPrediction, and I-TASSER), we screened hydrolyzed bioactive peptides from <i>Arca</i> species, identifying seventeen novel peptide candidates. Subsequent in vitro validation revealed three peptides (KW, WQIWYK, KGKWQIWYKSL) with significant anticancer activity, demonstrating both high biosafety and clinical potential. Our findings highlight <i>Arca</i> species proteins as a valuable source of therapeutic ACPs and establish bioinformatics as an efficient strategy for rapid discovery of bioactive peptides. This approach combines computational prediction with experimental validation, offering a robust framework for developing novel peptide-based therapeutics.https://www.mdpi.com/1420-3049/30/7/1640proteins from <i>Arca</i> speciesin silico analysisbioactive peptidesanticancer
spellingShingle Jixu Wu
Xiuhua Zhang
Yuting Jin
Man Zhang
Rongmin Yu
Liyan Song
Fei Liu
Jianhua Zhu
Investigation of Anticancer Peptides Derived from <i>Arca</i> Species Using In Silico Analysis
Molecules
proteins from <i>Arca</i> species
in silico analysis
bioactive peptides
anticancer
title Investigation of Anticancer Peptides Derived from <i>Arca</i> Species Using In Silico Analysis
title_full Investigation of Anticancer Peptides Derived from <i>Arca</i> Species Using In Silico Analysis
title_fullStr Investigation of Anticancer Peptides Derived from <i>Arca</i> Species Using In Silico Analysis
title_full_unstemmed Investigation of Anticancer Peptides Derived from <i>Arca</i> Species Using In Silico Analysis
title_short Investigation of Anticancer Peptides Derived from <i>Arca</i> Species Using In Silico Analysis
title_sort investigation of anticancer peptides derived from i arca i species using in silico analysis
topic proteins from <i>Arca</i> species
in silico analysis
bioactive peptides
anticancer
url https://www.mdpi.com/1420-3049/30/7/1640
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