Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 2/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.36 |
| ▸ | AAK1 | Q2M2I8 | 3/20 | 0.35 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.34 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.34 |
| ▸ | CYP46A1 | Q9Y6A2 | 2/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 9/20 | 0.33 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.33 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL18655107 | 0.80 | PIM1 (0.39) | PIM1IRAK4NTRK1 | |
| SCHEMBL18654801 | 0.78 | PIM1 (0.41) | PIM1IRAK4AAK1DYRK3CCNT1 | |
| SCHEMBL14896964 | 0.78 | IRAK4 (0.51) | IRAK4AAK1NTRK1NTRK3NTRK2 | |
| SCHEMBL18654767 | 0.78 | IRAK4 (0.51) | IRAK4AAK1NTRK1NTRK3NTRK2 | |
| SCHEMBL18654799 | 0.76 | PIM1 (0.40) | PIM1IRAK4AAK1DYRK3CCNT1 | |
| SCHEMBL23408640 | 0.72 | PIM1 (0.40) | PIM1IRAK4AAK1DYRK3CCNT1 | |
| SCHEMBL14881458 | 0.72 | IRAK4 (0.47) | PIM1IRAK4AAK1DYRK3CCNT1 | |
| SCHEMBL14881490 | 0.72 | IRAK4 (0.47) | PIM1IRAK4AAK1DYRK3CCNT1 | |
| SCHEMBL20098872 | 0.72 | NTRK1 (0.39) | PIM1AAK1NTRK1NTRK3NTRK2 | |
| SCHEMBL14881665 | 0.71 | PIM1 (0.42) | PIM1IRAK4AAK1DYRK3CCNT1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2768509-B1 | SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2017-03-22 | — | — | EP | disclosed |