Research Article
Unveiling Neuroprotective Potential of Spice Plant-Derived Compounds against Alzheimer’s Disease: Insights from Computational Studies
Table 4
Results of the pharmacophore mapping experiment of the two best ligands for each of the protein.
| Protein | Name of the compounds | Fit score | Normalized fit score | Pharmacophore features (numbers) | Hydrophobic center | Positively charged center | Negatively charged center | H-bond donor | H-bond acceptor | Aromatic ring |
| AChE | Quercetin | 2.97 | 0.7425 | 2 | 0 | 0 | 2 | 0 | 0 | Myricetin | 2.986 | 0.7464 | 2 | 0 | 0 | 2 | 0 | 0 |
| BuChE | Alpha-amyrin | 4 | 1 | 4 | 0 | 0 | 0 | 0 | 0 | Beta-chlorogenin | 3 | 1 | 3 | 0 | 0 | 0 | 0 | 0 |
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