Identifying Active Compounds and Mechanism of Chi on Anti-Colon Cancer by Network Pharmacology and Experimental Validation.

Evid Based Complement Alternat Med

Guangxi Key Laboratory of Efficacy Study on Chinese Materia Medica, Guangxi University of Chinese Medicine, Nanning 530200, Guangxi, China.

Published: August 2021

Camellia Chi (CNC) is a traditional Chinese medicine (TCM) with anticancer property. However, its underlying mechanisms of anti-colon cancer (CC) remain unknown. Therefore, a systematic approach is proposed in the present study to elucidate the anticancer mechanisms of CNC based on network pharmacology and experimental validation. Initially, the potential active ingredients of CNC were verified via the TCMSP database based on the oral bioavailability (OB) and drug-likeness (DL) terms. Hub targets of CNC were acquired from SwissTarget prediction and TCMSP databases, and target genes related to CC were gathered from GeneCards and OMIM databases. Cytoscape was used to establish the compound-target networks. Next, the hub target genes collected from the CNC and CC were parsed via GO and KEGG analysis. Results of GO and KEGG analysis reveal that quercetin and luteolin in CNC, VEGFA and AKT1 targets, and PI3K-Akt pathway were associated with the suppression of CC. Besides, the result of molecular docking unveils that VEGFA demonstrates the most powerful binding affinity among the binding outcomes. This finding was successfully validated using HCT116 cell model experiment. In conclusion, this study proved the usefulness of integrating network pharmacology with experiments in the elucidation of underlying molecular mechanisms of TCM.

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http://www.ncbi.nlm.nih.gov/pmc/articles/PMC8413042PMC
http://dx.doi.org/10.1155/2021/7169211DOI Listing

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