Table 1. Top 10 FDA-approved drugs with docking score based on high-throughput virtual screening.
ID | Name | Chemical structure | Docking score |
ZINC22448696 | Indinavir | ![]() |
49.5328 |
ZINC3944422 | Ritonavir | ![]() |
49.4166 |
ZINC3914596 | Saquinavir | ![]() |
49.3129 |
ZINC3951740 | Lopinavir | ![]() |
49.0524 |
ZINC85537014 | Cobicistat | ![]() |
48.9127 |
ZINC100016058 | Tipranavir | ![]() |
48.8735 |
ZINC3831151 | Montelukast | ![]() |
48.8146 |
ZINC49841054 | Kyprolis | ![]() |
48.8093 |
ZINC29571072 | Isavuconazonium | ![]() |
47.9368 |
ZINC14879972 | Tigecycline | ![]() |
47.9302 |