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Comparison and Analysis on the Existing Single-Herbal Strategies against Viral Myocarditis
PURPOSE: Herbal medicine is one of crucial symbols of Chinese national medicine. Investigation on molecular responses of different herbal strategies against viral myocarditis is immeasurably conducive to targeting drug development in the current international absence of miracle treatment. METHODS: L...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Hindawi
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8371739/ https://www.ncbi.nlm.nih.gov/pubmed/34456633 http://dx.doi.org/10.1155/2021/9952620 |
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author | Cao, Yu Liu, Yang Zhang, Tian Pan, Jing Lei, Wei Zhang, Boli |
author_facet | Cao, Yu Liu, Yang Zhang, Tian Pan, Jing Lei, Wei Zhang, Boli |
author_sort | Cao, Yu |
collection | PubMed |
description | PURPOSE: Herbal medicine is one of crucial symbols of Chinese national medicine. Investigation on molecular responses of different herbal strategies against viral myocarditis is immeasurably conducive to targeting drug development in the current international absence of miracle treatment. METHODS: Literature retrieval platforms were applied in the collection of existing empirical evidences for viral myocarditis-related single-herbal strategies. SwissTargetPrediction, Metascape, and Discovery Studio coordinating with multidatabases investigated underlying target genes, interactive proteins, and docking molecules in turn. RESULTS: Six single-herbal medicines consisting of Huangqi (Hedysarum Multijugum Maxim), Yuganzi (Phyllanthi Fructus), Kushen (Sophorae Flavescentis Radix), Jianghuang (Curcumaelongae Rhizoma), Chaihu (Radix Bupleuri), and Jixueteng (Spatholobus Suberectus Dunn) meet the requirement. There were 11 overlapped and 73 unique natural components detected in these herbs. SLC6A2, SLC6A4, NOS2, PPARA, PPARG, ACHE, CYP2C19, CYP51A1, and CHRM2 were equally targeted by six herbs and identified as viral myocarditis-associated symbols. MCODE algorithm exposed the hub role of SRC and EGFR in strategies without Jianghuang. Subsequently, we learned intermolecular interactions of herbal components and their targeting heart-tissue-specific CHRM2, FABP3, TNNC1, TNNI3, TNNT2, and SCN5A and cardiac-myocytes-specific IL6, MMP1, and PLAT coupled with viral myocarditis. Ten interactive characteristics such as π-alkyl and van der Waals were modeled in which ARG111, LYS253, ILE114, and VAL11 on cardiac troponin (TNNC1-TNNI3-TNNT2) and ARG208, ASN106, and ALA258 on MMP1 fulfilled potential communicating anchor with ellagic acid, 5α, 9α-dihydroxymatrine, and leachianone g via hydrogen bond and hydrophobic interaction, respectively. CONCLUSIONS: The comprehensive outcomes uncover differences and linkages between six herbs against viral myocarditis through component and target analysis, fostering development of drugs. |
format | Online Article Text |
id | pubmed-8371739 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2021 |
publisher | Hindawi |
record_format | MEDLINE/PubMed |
spelling | pubmed-83717392021-08-26 Comparison and Analysis on the Existing Single-Herbal Strategies against Viral Myocarditis Cao, Yu Liu, Yang Zhang, Tian Pan, Jing Lei, Wei Zhang, Boli Genet Res (Camb) Research Article PURPOSE: Herbal medicine is one of crucial symbols of Chinese national medicine. Investigation on molecular responses of different herbal strategies against viral myocarditis is immeasurably conducive to targeting drug development in the current international absence of miracle treatment. METHODS: Literature retrieval platforms were applied in the collection of existing empirical evidences for viral myocarditis-related single-herbal strategies. SwissTargetPrediction, Metascape, and Discovery Studio coordinating with multidatabases investigated underlying target genes, interactive proteins, and docking molecules in turn. RESULTS: Six single-herbal medicines consisting of Huangqi (Hedysarum Multijugum Maxim), Yuganzi (Phyllanthi Fructus), Kushen (Sophorae Flavescentis Radix), Jianghuang (Curcumaelongae Rhizoma), Chaihu (Radix Bupleuri), and Jixueteng (Spatholobus Suberectus Dunn) meet the requirement. There were 11 overlapped and 73 unique natural components detected in these herbs. SLC6A2, SLC6A4, NOS2, PPARA, PPARG, ACHE, CYP2C19, CYP51A1, and CHRM2 were equally targeted by six herbs and identified as viral myocarditis-associated symbols. MCODE algorithm exposed the hub role of SRC and EGFR in strategies without Jianghuang. Subsequently, we learned intermolecular interactions of herbal components and their targeting heart-tissue-specific CHRM2, FABP3, TNNC1, TNNI3, TNNT2, and SCN5A and cardiac-myocytes-specific IL6, MMP1, and PLAT coupled with viral myocarditis. Ten interactive characteristics such as π-alkyl and van der Waals were modeled in which ARG111, LYS253, ILE114, and VAL11 on cardiac troponin (TNNC1-TNNI3-TNNT2) and ARG208, ASN106, and ALA258 on MMP1 fulfilled potential communicating anchor with ellagic acid, 5α, 9α-dihydroxymatrine, and leachianone g via hydrogen bond and hydrophobic interaction, respectively. CONCLUSIONS: The comprehensive outcomes uncover differences and linkages between six herbs against viral myocarditis through component and target analysis, fostering development of drugs. Hindawi 2021-08-07 /pmc/articles/PMC8371739/ /pubmed/34456633 http://dx.doi.org/10.1155/2021/9952620 Text en Copyright © 2021 Yu Cao et al. https://creativecommons.org/licenses/by/4.0/This is an open access article distributed under the Creative Commons Attribution License, which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited. |
spellingShingle | Research Article Cao, Yu Liu, Yang Zhang, Tian Pan, Jing Lei, Wei Zhang, Boli Comparison and Analysis on the Existing Single-Herbal Strategies against Viral Myocarditis |
title | Comparison and Analysis on the Existing Single-Herbal Strategies against Viral Myocarditis |
title_full | Comparison and Analysis on the Existing Single-Herbal Strategies against Viral Myocarditis |
title_fullStr | Comparison and Analysis on the Existing Single-Herbal Strategies against Viral Myocarditis |
title_full_unstemmed | Comparison and Analysis on the Existing Single-Herbal Strategies against Viral Myocarditis |
title_short | Comparison and Analysis on the Existing Single-Herbal Strategies against Viral Myocarditis |
title_sort | comparison and analysis on the existing single-herbal strategies against viral myocarditis |
topic | Research Article |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8371739/ https://www.ncbi.nlm.nih.gov/pubmed/34456633 http://dx.doi.org/10.1155/2021/9952620 |
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