Mapping of the test set compounds onto hypothesis 10.
| Test compd | 3D mapping onto hypo 1 | Fit value | IC50 |
|---|---|---|---|
| T1 |
|
4.785 | 2 |
| T2 |
|
3.265 | 8 |
| T3 |
|
3.598 | 19 |
| T4 |
|
3.652 | 32 |
| T5 |
|
2.231 | — |
| T6 |
|
1.873 | — |
| T7 |
|
1.037 | — |
| T8 |
|
2.458 | — |
| Test compd | 3D mapping onto hypo 1 | Fit value | IC50 |
|---|---|---|---|
| T1 |
|
4.785 | 2 |
| T2 |
|
3.265 | 8 |
| T3 |
|
3.598 | 19 |
| T4 |
|
3.652 | 32 |
| T5 |
|
2.231 | — |
| T6 |
|
1.873 | — |
| T7 |
|
1.037 | — |
| T8 |
|
2.458 | — |