Abstract
In this study, the binding efficiency of 10 coumarin derivatives with some selected proteins from Dengue virus through in silico method was done. By virtual screening and docking results, we have found that the hybrid derivative between coumarin and isatin has the most convenient binding activity for the seven selected proteins.
Highlights
In this study, the binding efficiency of 10 coumarin derivatives with some selected proteins from Dengue virus through in silico method was done
By virtual screening and docking results, we have found that the hybrid derivative between coumarin and isatin has the most convenient binding activity for the seven selected proteins
Coumarin ring can be considered as a privileged scaffold and an ideal framework for the design of compounds that can interact with different targets [4-6]
Summary
The binding efficiency of 10 coumarin derivatives with some selected proteins from Dengue virus through in silico method was done. By virtual screening and docking results, we have found that the hybrid derivative between coumarin and isatin has the most convenient binding activity for the seven selected proteins. The best docking pose for the individual ligands can be obtained for all the seven dengue viral proteins.
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