Estradiol is a key candidate for treating Ankylosing Spondylolisthesis with Traditional Chinese Medicine.
Ankylosing spondylitis
ESR1
Estradiol
Inflammation
Network pharmacology
TCM
Journal
Computers in biology and medicine
ISSN: 1879-0534
Titre abrégé: Comput Biol Med
Pays: United States
ID NLM: 1250250
Informations de publication
Date de publication:
09 2023
09 2023
Historique:
received:
20
01
2023
revised:
19
06
2023
accepted:
25
06
2023
medline:
11
9
2023
pubmed:
30
7
2023
entrez:
29
7
2023
Statut:
ppublish
Résumé
Some Traditional Chinese Medicine (TCM) has shown anti-inflammatory and immunosuppressive effects on Ankylosing Spondylitis (AS) treatment. Wan Bikang (WBK) and Wan Biqing (WBQ) are two traditional empirical formulas for AS. However, the mechanism of their effects on AS is largely unknown. This study deciphered the underlying common molecular mechanisms of these TCM treatments for AS. The ultra-high-performance liquid chromatography-triple/time-of-flight mass spectrometry (UHPLC-Q-TOF-MS/MS) assays were employed to detect herbal ingredients. Target proteins of herbal ingredients were identified by ChEMBL Database. To infer the relationships between ingredients and AS-related proteins, network pharmacology was employed. Protein-protein interaction (PPI) network and core target analyses were carried out with tools Cytoscape and STRING. To find out the molecular basis and target of AS, molecular docking and an in vitro experiment were also conducted. It is found that estradiol may participate in the treatment of AS via the inhibition of inflammatory factors, and Estrogen Receptor 1 (ESR1) appears to be a key target. This research offers insight into the therapeutic mechanism of TCM formulas for AS and furthers our understanding of TCM pharmacology.
Identifiants
pubmed: 37515871
pii: S0010-4825(23)00671-6
doi: 10.1016/j.compbiomed.2023.107206
pii:
doi:
Substances chimiques
Estradiol
4TI98Z838E
Drugs, Chinese Herbal
0
Types de publication
Journal Article
Research Support, Non-U.S. Gov't
Langues
eng
Sous-ensembles de citation
IM
Pagination
107206Informations de copyright
Copyright © 2023. Published by Elsevier Ltd.
Déclaration de conflit d'intérêts
Declaration of competing interest We do not have any financial or personal relationships with other individuals or organizations that may inappropriately influence our work. There are no professional or personal interests of any kind in any product, services and/or companies that could be interpreted as influencing the content of the manuscript, or the review of the manuscript. We declared no conflict of interest.