Bioactivities of Compounds from Elephantopus scaber, an Ethnomedicinal Plant from Southwest China

Table 2

The potential bioactivity screening results of compound 1.

Pharmacophore	Name of pharmacophore	Type	Fit value	Biological function(s)	Reference
2zb8-01-s	Prostaglandin reductase 2	Protein	4.05271	Inflammation	[14]
3kjs-01	Dihydrofolate reductase-thymidylate synthase	Protein	3.9615	Malarial parasites, anticancer, and inflammation	[15–17]
2uue-01	Cell division protein kinase 2	Protein	3.60758	Cell division	[18, 19]
2w4i-01-s	Glutamate racemase	Protein	3.55547	Antibiotics	[20–24]
3k6l-01	Peptide deformylase	Protein	3.51102	Antibiotic	[25, 26]
3md7-01	beta-lactamase-like	Protein	3.41887	Antibiotic	[27, 28]
2ovy-01	Phosphodiesterase 10A	Protein	3.41834	Schizophrenia and; nervous system	[29–31]
3ac8-01	Protooncogene tyrosine-protein kinase LCK	Protein	3.39142	Antitumor	[32, 33]
3f7z-01	G17 glycogen synthase kinase-3-beta	Protein	3.30076	Antitumor and neurodegenerative disease	[34]
3cgy-01	Virulence sensor histidine kinase phoQ	Protein	3.28695	Antibiotic	[35, 36]
2qe5-01	RNA-directed RNA polymerase	Protein	3.28198	Antivirus	[37, 38]
1dvx-01	Transthyretin	Protein	3.27421	Antitumor and obesity	[39, 40]
2brc-01	ATP-dependent molecular chaperone HSP90	Protein	3.26648	Antitumor and antivirus	[41, 42]
1c1b-01-s	HIV-1 reverse transcriptase (A-chain)	Protein	3.25549	Anti-HIV	[43–45]