Table 1.
Dock score of the top nine interacting drugs with multiple target proteins
Name of the ligand | Docking score | |||||
---|---|---|---|---|---|---|
AChE (4EY6) | BuChE (1P0M) | MAO A (2Z5X) | BACE 1 (3L5E) | BACE 1 (4D8C) | NMDA (1PBQ) | |
Positive control | Donepezil − 11.02 |
Rivastigmine − 3.123 |
Marplan − 8.354 |
LY2886721 − 6.123 |
LY2886721 − 6.80 |
Memantine − 4.029 |
Sulmepride | − 11.508 | – | – | − 7.246 | − 3.649 | − 4.831 |
Promazine hydrochloride | − 11.074 | – | − 7.978 | − 5.907 | − 6.784 | − 4.711 |
Bromperidol | − 10.927 | − 8.111 | − 5.52 | − 6.576 | − 7.486 | − 5.247 |
Anisopirol | − 11.001 | − 7.977 | − 5.26 | − 6.083 | − 8.169 | − 6.903 |
Melperone | − 11.423 | − 6.663 | − 8.91 | − 7.249 | − 6.524 | − 6.067 |
Pimozide | − 14.969 | − 8.13 | – | − 8.386 | − 8.968 | − 6.854 |
Benperidol | − 14.425 | − 7.163 | − 6.598 | − 6.742 | − 9.076 | − 6.778 |
Azabuperone | − 11.882 | − 7.938 | − 5.861 | − 7.584 | − 4.167 | − 6.51 |
Anisoperidone | – | − 7.989 | − 6.324 | − 8.513 | − 7.11 | − 5.196 |