TY - JOUR
T1 - Identification of the active compounds and significant pathways of yinchenhao decoction based on network pharmacology
AU - Huang, Jihan
AU - Cheung, Fan
AU - Tan, Hor Yue
AU - Hong, Ming
AU - Wang, Ning
AU - Yang, Juan
AU - Feng, Yibin
AU - Zheng, Qingshan
N1 - Funding Information:
The present study was supported by the Shanghai Education Commission (ZY3-CCCX-3-1001), the Research Council of the University of Hong Kong (104003422, 104004092) and the Research Grants Committee of Hong Kong, HKSAR (17152116).
Publisher copyright:
© Huang et al.
PY - 2017/10
Y1 - 2017/10
N2 - Yinchenhao decoction (YCHD) is a traditional Chinese medicine formulation, which has been widely used for the treatment of jaundice for 2,000 years. Currently, YCHD is used to treat various liver disorders and metabolic diseases, however its chemical/pharmacologic profiles remain to be elucidated. The present study identified the active compounds and significant pathways of YCHD based on network pharmacology. All of the chemical ingredients of YCHD were retrieved from the Traditional Chinese Medicine Systems Pharmacology database. Absorption, distribution, metabolism and excretion screening with oral bioavailability (OB) screening, drug-likeness (DL) and intestinal epithelial permeability (Caco-2) evaluation were applied to discover the bioactive compounds in YCHD. Following this, target prediction, pathway identification and network construction were employed to clarify the mechanism of action of YCHD. Following OB screening, and evaluation of DL and Caco-2, 34 compounds in YCHD were identified as potential active ingredients, of which 30 compounds were associated with 217 protein targets. A total of 31 significant pathways were obtained by performing enrichment analyses of 217 proteins using the JEPETTO 3.x plugin, and 16 classes of gene-associated diseases were revealed by performing enrichment analyses using Database for Annotation, Visualization and Integrated Discovery v6.7. The present study identified potential active compounds and significant pathways in YCHD. In addition, the mechanism of action of YCHD in the treatment of various diseases through multiple pathways was clarified.
AB - Yinchenhao decoction (YCHD) is a traditional Chinese medicine formulation, which has been widely used for the treatment of jaundice for 2,000 years. Currently, YCHD is used to treat various liver disorders and metabolic diseases, however its chemical/pharmacologic profiles remain to be elucidated. The present study identified the active compounds and significant pathways of YCHD based on network pharmacology. All of the chemical ingredients of YCHD were retrieved from the Traditional Chinese Medicine Systems Pharmacology database. Absorption, distribution, metabolism and excretion screening with oral bioavailability (OB) screening, drug-likeness (DL) and intestinal epithelial permeability (Caco-2) evaluation were applied to discover the bioactive compounds in YCHD. Following this, target prediction, pathway identification and network construction were employed to clarify the mechanism of action of YCHD. Following OB screening, and evaluation of DL and Caco-2, 34 compounds in YCHD were identified as potential active ingredients, of which 30 compounds were associated with 217 protein targets. A total of 31 significant pathways were obtained by performing enrichment analyses of 217 proteins using the JEPETTO 3.x plugin, and 16 classes of gene-associated diseases were revealed by performing enrichment analyses using Database for Annotation, Visualization and Integrated Discovery v6.7. The present study identified potential active compounds and significant pathways in YCHD. In addition, the mechanism of action of YCHD in the treatment of various diseases through multiple pathways was clarified.
KW - Intracellular targets
KW - Network pharmacology
KW - Significant pathways
KW - Yinchenhao decoction
UR - http://www.scopus.com/inward/record.url?scp=85028711585&partnerID=8YFLogxK
U2 - 10.3892/mmr.2017.7149
DO - 10.3892/mmr.2017.7149
M3 - Journal article
C2 - 28791364
AN - SCOPUS:85028711585
SN - 1791-2997
VL - 16
SP - 4583
EP - 4592
JO - Molecular Medicine Reports
JF - Molecular Medicine Reports
IS - 4
ER -