Table 3.
Summary of the top 5 ligands which had the highest potency.
| Name | KLK-6 MolDock score | PAR-1 MolDock score | S1RP1 MolDock score | F | 1stMT index (%) | 2ndMT index (%) | PMT |
|---|---|---|---|---|---|---|---|
| Zb0Ad4 | −210.2 | −174.8 | −177.9 | 326.2 | 97.2 | 82.6 | 261.9 |
| Zb0C0l1 | −193.4 | −161.3 | −188.9 | 314.8 | 97.5 | 84.8 | 260.5 |
| Zc0B0l1 | −190.1 | −160.9 | −176.8 | 305.4 | 98.2 | 86.6 | 259.5 |
| Zd0Ap2 | −167.1 | −153.4 | −165.5 | 280.8 | 99.4 | 92.6 | 258.5 |
| Zb0Ad1 | −202.5 | −164.5 | −183.8 | 319.1 | 97.2 | 83.2 | 257.9 |