Table 6 Predicted values and calculated h of pIC50 (µM) according to different methods
Compound | Molecular structure | Pubchem CID | Pred (PIC50) for PIM1 | h | Pred (PIC50) for PIM2 | h |
|---|---|---|---|---|---|---|
1 |
| 68328588 | 7.782 | 0.122 | 7.455 | 0.213 |
2 |
| 45377352 | 10.367 | 0.906 | 9.497 | 1.117 |
3 |
| 68328129 | 7.316 | 0.352 | 7.243 | 0.162 |
4 |
| 68327929 | 8.332 | 0.102 | 7.513 | 0.330 |
5 |
| 68328158 | 8.311 | 0.074 | 7.072 | 1.109 |
6 |
| 68328259 | 8.434 | 0.113 | 7.958 | 0.106 |
7 |
| 68328426 | 8.347 | 0.089 | 8.026 | 0.151 |
8 |
| 68328539 | 8.137 | 0.387 | 6.699 | 0.111 |
9 |
| 68328547 | 8.282 | 0.1023 | 7.594 | 0.0964 |
10 |
| 68328676 | 8.138 | 0.0739 | 7.068 | 0.7669 |
11 |
| 68328891 | 8.329 | 0.0860 | 8.244 | 0.2909 |
12 |
| 68356801 | 8.745 | 0.2543 | 8.137 | 0.9468 |
