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Top 10 CDK1-targeted compounds that identified by pharmacophores-based virtual screening.
| Rank | CDK1/Cks2 (6GU7) | Score | RMSD |
|---|---|---|---|
| 1 | Molport-003-703-800 | -8.61 | 4.358 |
| 2 | Molport-002-942-764 | -8.60 | 2.171 |
| 3 | Molport-002-696-165 | -8.60 | 6.768 |
| 4 | Molport-007-552-096 | -8.59 | 1.363 |
| 5 | Molport-000-779-098 | -8.57 | 3.074 |
| 6 | Molport-023-277-074 | -8.57 | 3.260 |
| 7 | Molport-002-685-121 | -8.57 | 4.044 |
| 8 | Molport-007-951-239 | -8.57 | 4.861 |
| 9 | Molport-002-694-975 | -8.56 | 4.649 |
| 10 | Molport-016-638-322 | -8.54 | 3.059 |
