Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 17/20 | 0.39 |
| ▸ | NTRK3 | Q16288 | 6/20 | 0.39 |
| ▸ | NTRK2 | Q16620 | 6/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.36 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20098857 | 0.86 | NTRK1 (0.37) | NTRK1NTRK3NTRK2AAK1PIM1 | |
| SCHEMBL20098873 | 0.82 | NTRK1 (0.38) | NTRK1 | |
| SCHEMBL14896935 | 0.80 | NTRK1 (0.46) | NTRK1NTRK3NTRK2RETKDR | |
| SCHEMBL18654801 | 0.78 | PIM1 (0.41) | NTRK1NTRK3NTRK2AAK1RET | |
| SCHEMBL22083695 | 0.73 | NTRK1 (0.41) | NTRK1AAK1 | |
| SCHEMBL14897819 | 0.72 | IRAK4 (0.50) | NTRK1NTRK3NTRK2AAK1RET | |
| SCHEMBL18654877 | 0.72 | PIM1 (0.36) | NTRK1NTRK3NTRK2AAK1PIM1 | |
| SCHEMBL14897276 | 0.71 | IRAK4 (0.53) | NTRK1NTRK3NTRK2AAK1RET | |
| SCHEMBL18654799 | 0.71 | PIM1 (0.40) | NTRK1AAK1PIM1 | |
| SCHEMBL23408640 | 0.71 | PIM1 (0.40) | NTRK1NTRK3NTRK2AAK1PIM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9957271-B2 | Substituted bicyclic aza-heterocycles and analogues as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2018-05-01 | — | — | US | disclosed |