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. 2022 Jul 30;2022:6726438. doi: 10.1155/2022/6726438

Table 4.

Binding energy scoring of the synthesized ligands (MSJ 1-10) with targeted proteins.

Ligands Binding energies (Kcal/mol)
Acetylcholinesterase Butyrylcholinesterase α-amylase α-Glucosidase
1EVE 4BDS 5U3A 5NN3
MSJ1 −6.5 −6.7 −7.1 −7.4
MSJ2 −8.7 −8.9 −8.2 −8.5
MSJ3 −6.9 −7.2 −7.4 −7.8
MSJ4 −7.5 −7.8 −7.1 −7.2
MSJ5 −6.9 −6.5 −6.5 −6.6
MSJ6 −7.1 −7.5 −7.4 −7.8
MSJ7 −7.4 −7.5 −7.4 −7.7
MSJ8 −6.9 −6.5 −6.4 −6.8
MSJ9 −6.6 −6.6 −6.7 −6.7
MSJ10 −9.5 −9.1 −8.2 −8.8
Galantamine −9.9 −9.6
Acarbose −9.1 −9.5