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Review on Compounds Isolated from Eriocaulaceae Family and Evaluation of Biological Activities by Machine Learning.

Authors :
Moreira, Laysa Lanes Pereira Ferreira
de Menezes, Renata Priscila Barros
Scotti, Luciana
Scotti, Marcus Tullius
Lacerda Júnior, Valdemar
Borges, Warley de Souza
Source :
Molecules; Nov2022, Vol. 27 Issue 21, p7186, 54p
Publication Year :
2022

Abstract

Eriocaulaceae is a pantropical family whose main center of biodiversity is in Brazil. In general, the family has about 1200 species, in which phytochemical and biological studies have shown a variety of structures and activities. The aim of this research is to compile the compounds isolated in the Eriocaulaceae family and carry out a computational study on their biological targets. The bibliographic research was carried out on six databases. Tables were built and organized according to the chemical class. In addition, a summary of the methods of isolating the compounds was also made. In the computational study were used ChEMBL platform, DRAGON 7.0, and the KNIME 4.4.0 software. Two hundred and twenty-two different compounds have been isolated in sixty-eight species, divided mainly into flavonoids and naphthopyranones, and minor compounds. The ligand-based virtual screening found promising molecules and molecules with multitarget potential, such as xanthones 194, 196, 200 and saponin 202, with xanthone 194 as the most promising. Several compounds with biological activities were isolated in the family, but the chemical profiles of many species are still unknown. The selected structures are a starting point for further studies to develop new antiparasitic and antiviral compounds based on natural products. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
14203049
Volume :
27
Issue :
21
Database :
Complementary Index
Journal :
Molecules
Publication Type :
Academic Journal
Accession number :
160217625
Full Text :
https://doi.org/10.3390/molecules27217186