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. 2024 Feb 29;20(2):103–109. doi: 10.6026/973206300200103

Table 5. Autodock binding energy scoring values of compounds on AChE and BACE-1.

Sl. No Ligands Proteins
AchE 4EY7 Affinity (Kcal.mol) BACE-1 5HDZ Affinity (Kcal.mol)
1 Petunidin -7.19 -6.72
2 Peonidin -7.69 -7.07
3 Pelargonidin -7.42 -7.11
4 Malvidin -8.69 -7.01
5 Delphinidin -6.76 -6.2
6 Cyanidin -8.01 -7.08
7 Tangeritin -9.24 -6.76
8 Luteolin -5.1 -6.3
9 Baicalein -7.79 -6.96
10 Apigenin -8.87 -6.38
11 Phloridzin -7.63 -5.91
12 Phloretin -7.9 -6.81
13 Chalcone -8.06 -7.14
14 Chalconaringenin -7.49 -6.3
15 Arbutin -6.82 -6.38
16 Epicatechin gallate -10.42 -7.47
17 Gallocatechin -7.03 -7.9
18 Catechin -7.97 -6.84
19 Taxifolin -8.67 -6.58
20 Rutin -8.59 -7.04
21 Quercitrin -9.22 -7.6
22 Quercetin -8.21 -6.54
23 Kaempferol -8.08 -6.37
24 Isoharmnetin -9.16 -8.96
25 Fisetin -10.11 -9.81
26 Naringenin -8.9 -6.55
27 Hesperidin -8.51 -7.73
28 Hesperetin -9.55 -6.42
29 Eriodictyol -8.23 -6.29
30 Sterubin -10.16 -8.96
31 Glycitein -8.53 -6.55
32 Genistin -9.92 -6.84
33 Formononetin -8.38 -6.97
34 Daidzin -8.93 -7.66
35 Biochainin A -8.47 -9.81
36 Donepezil -11.03 -8.83