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Molecular docking analysis of Indole based oxadiazoles with the H-binding protein from Treponema denticola .

Authors :
Kumaran P
Rengasamy G
Sekaran S
Sankaran K
Veeraraghavan VP
Eswaramoorthy R
Source :
Bioinformation [Bioinformation] 2023 Jan 31; Vol. 19 (1), pp. 79-84. Date of Electronic Publication: 2023 Jan 31 (Print Publication: 2023).
Publication Year :
2023

Abstract

Treponema denticola is a gram-negative bacteria that is associated with periodontal diseases. Literature derived, six indole based oxadiazole derivatives are docked with the target Factor H binding protein (fHbp) protein. Results show better docking interaction compared to clinically proven drugs and all compounds obey Lipinski's rule of five. Hence, the compounds were inferred to be potential inhibitors for factor H binding protein of Treponema denticola .<br /> (© 2023 Biomedical Informatics.)

Details

Language :
English
ISSN :
0973-2063
Volume :
19
Issue :
1
Database :
MEDLINE
Journal :
Bioinformation
Publication Type :
Academic Journal
Accession number :
37720299
Full Text :
https://doi.org/10.6026/97320630019079