Identification of Active Compound from Mitragyna speciosa Leave as Antiinflammation Agent: In Silico Study

Autor:	Ihsanul Arief, Erwan Kurnianto
Rok vydání:	2022
Předmět:	General Medicine
Zdroj:	Acta Chimica Asiana. 5:218-223
ISSN:	2550-049X 2550-0503
DOI:	10.29303/aca.v5i2.139
Popis:	The study aims to identify the most responsible compound for the antiinflammation activity from Mitragyna speciosa leaves. Seventeen compounds previously reported to have been isolated from the leave were virtually screened against human 5-lipoxygenase protein and analyzed according to their binding energies. The native ligand used was arachidonic acid, and mitragynine was found to be the strongest binding compound (Pubchem ID: 3034396). In addition, ADMET profiling shows that mitragynine was not violating Lipinski’s rule of five and was not toxic.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::6cc2aa9cfdbdae576349d24b24ee0ac2 https://doi.org/10.29303/aca.v5i2.139 Zobrazit plný text záznamu