Identification of phytochemical compounds of <i>Fagopyrum dibotrys</i> and their targets by metabolomics, network pharmacology and molecular docking studies.

Zhang, Min; Zhang, Xinke; Pei, Jin; Guo, Baolin; Zhang, Guoshuai; Li, Minhui; Huang, Linfang

Identification of phytochemical compounds of Fagopyrum dibotrys and their targets by metabolomics, network pharmacology and molecular docking studies.

Zhang, Min; Zhang, Xinke; Pei, Jin; Guo, Baolin; Zhang, Guoshuai; Li, Minhui; Huang, Linfang.

Afiliación

Zhang M; A Key Laboratory of Chinese Medicine Resources Conservation, State Administration of Traditional Chinese Medicine of the People's Republic of China, Institute of Medicinal Plant Development, Chinese Academy of Medical Sciences & Peking Union Medical College, Beijing, 100193, China.
Zhang X; College of Pharmacy, Baotou Medical College, Baotou, 014040, China.
Pei J; Inner Mongolia Autonomous Region Hospital of Traditional Chinese Medicine, Hohhot, 010020, China.
Guo B; Inner Mongolia Academy of Chinese and Mongolian Medicine, Hohhot, 010010, China.
Zhang G; A Key Laboratory of Chinese Medicine Resources Conservation, State Administration of Traditional Chinese Medicine of the People's Republic of China, Institute of Medicinal Plant Development, Chinese Academy of Medical Sciences & Peking Union Medical College, Beijing, 100193, China.
Li M; State Key Laboratory of Southwestern Chinese Medicine Resources, Chengdu University of Traditional Chinese Medicine, Chengdu, 611137, China.
Huang L; A Key Laboratory of Chinese Medicine Resources Conservation, State Administration of Traditional Chinese Medicine of the People's Republic of China, Institute of Medicinal Plant Development, Chinese Academy of Medical Sciences & Peking Union Medical College, Beijing, 100193, China.

Heliyon ; 9(3): e14029, 2023 Mar.

Article en En | MEDLINE | ID: mdl-36911881

Palabras clave

ARDS, acute respiratory distress syndrome; BC, BetweennessCentrality; CC, ClosenessCentrality; CHM, Chinese herbal medicines; COVID-19 related ALI, Coronavirus disease 2019 related acute lung injury; Coronavirus disease 2019 related acute lung injury; DL, drug-like properties; Fagopyrum dibotrys; GO, Gene Ontology; KEGG, Kyoto Encyclopedia of Genes and Genomes; LC-MS, liquid chromatography-mass spectrometry; Metabolomics; Molecular docking; NC, NeighborhoodConnectivity; NSCLC, Non-small cell lung carcinoma; Network pharmacology; OB, oral bioavailability; PARP-1, Poly(ADP-ribose)polymerase-1; PDB, Protein Data Bank database; PPI network, protein-protein interaction network; RMSD, Root mean square deviation; SARS-CoV-2, severe acute respiratory syndrome coronavirus 2; TCM, traditional Chinese medicine; TCMSP, traditional Chinese medicine systems pharmacology database and analysis platform; WTM, widely targeted metabolome

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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Tipo de estudio: Diagnostic_studies / Prognostic_studies Idioma: En Revista: Heliyon Año: 2023 Tipo del documento: Article País de afiliación: China Pais de publicación: Reino Unido

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