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Targets of Danshen's Active Components for Activating Blood Circulation Activities
Liu Hai-Bo2; Xu Jun1; Peng Yong2; Zhou Jia-Ju3; Xiao Pei-Gen2; Xu, J
2010
Source PublicationACTA PHYSICO-CHIMICA SINICA
ISSN1000-6818
Volume26Issue:1Pages:199-205
AbstractThe active components in salvia miltiorrhiza bunge (danshen) include danshensu, labiatenic acid, and tanshinone, and they are known to be key compounds for danshen's blood-activating effect in traditional Chinese medicine. Studies show that these compounds have some common scaffolds. A systematic investigation was conducted to locate the targets of these active components among proteins with reported crystal structures. A structural informatics knowledgebase derived from protein structure and ligand-binding mode information was employed in this investigation. Furthermore, docking methods were used to rationally discover the relationship between the scaffold characteristics and the binding ability with the proteins. Results indicate that the active components comprehensively inhibit the metabolic network of adrenaline, which is a strong endogenetic cardiovascular activator. Consequently, adrenaline and its derivatives are accumulated and blood circulation is activated. We propose that key enzymes in the metabolic pathway of adrenaline including phenylethanolamine N-methyltransferase, catechol O-methyltransferase, and monoamine oxidases are targets for the active components in danshen. This research aids in the understanding of the mechanism of danshen's activating blood action.
KeywordDrug Target Salvia Miltiorrhiza Bunge (Danshen) Danshensu Traditional Chinese Medicine Activating Blood
SubtypeArticle
WOS HeadingsScience & Technology ; Physical Sciences
DOI10.3866/PKU.WHXB20091222
Indexed BySCI
Language英语
WOS KeywordCATECHOL-O-METHYLTRANSFERASE ; TANDEM MASS-SPECTROMETRY ; RAT CORONARY-ARTERY ; SALVIA-MILTIORRHIZA ; CRYSTAL-STRUCTURES ; CALCIUM-CHANNELS ; INHIBITION ; EXTRACT
WOS Research AreaChemistry
WOS SubjectChemistry, Physical
WOS IDWOS:000273849300032
Citation statistics
Cited Times:9[WOS]   [WOS Record]     [Related Records in WOS]
Document Type期刊论文
Version出版稿
Identifierhttp://ir.ipe.ac.cn/handle/122111/6237
Collection多相复杂系统国家重点实验室
Corresponding AuthorXu, J
Affiliation1.Sun Yat Sen Univ, Sch Pharmaceut Sci, Guangzhou 510275, Guangdong, Peoples R China
2.Chinese Acad Med Sci, Inst Med Plant Dev, Peking Union Med Coll, Beijing 100193, Peoples R China
3.Chinese Acad Sci, Inst Proc Engn, Beijing 100190, Peoples R China
Recommended Citation
GB/T 7714
Liu Hai-Bo,Xu Jun,Peng Yong,et al. Targets of Danshen's Active Components for Activating Blood Circulation Activities[J]. ACTA PHYSICO-CHIMICA SINICA,2010,26(1):199-205.
APA Liu Hai-Bo,Xu Jun,Peng Yong,Zhou Jia-Ju,Xiao Pei-Gen,&Xu, J.(2010).Targets of Danshen's Active Components for Activating Blood Circulation Activities.ACTA PHYSICO-CHIMICA SINICA,26(1),199-205.
MLA Liu Hai-Bo,et al."Targets of Danshen's Active Components for Activating Blood Circulation Activities".ACTA PHYSICO-CHIMICA SINICA 26.1(2010):199-205.
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