Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP46A1 | Q9Y6A2 | 4/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.38 |
| ▸ | USP2 | O75604 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL14840531 | 0.88 | CYP46A1 (0.54) | CYP46A1CYP2C19MAPK1CYP3A4SMN1; SMN2 | |
| SCHEMBL14871788 | 0.81 | CYP46A1 (0.42) | CYP46A1CYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL14840622 | 0.77 | CYP46A1 (0.67) | CYP46A1CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL14849114 | 0.75 | CYP46A1 (0.57) | CYP46A1CYP2C19CYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL14849066 | 0.71 | CYP46A1 (0.52) | CYP46A1CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL14840628 | 0.71 | CYP46A1 (0.79) | CYP46A1CYP2C19CYP3A4SMN1; SMN2CYP2D6 | |
| SCHEMBL14849116 | 0.70 | CYP46A1 (0.70) | CYP46A1CYP2C19CYP3A4CYP2C9TSHR | |
| SCHEMBL14840550 | 0.68 | CYP46A1 (0.80) | CYP46A1CYP2C19CYP3A4SMN1; SMN2CYP2D6 | |
| SCHEMBL14840316 | 0.67 | CYP46A1 (0.49) | CYP46A1CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL22719361 | 0.66 | CYP46A1 (0.45) | CYP46A1CYP2C19CYP3A4SMN1; SMN2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013054822-A1 | 1 - ARYLCARBONYL - 4 - OXY - PIPERIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-04-18 | — | — | WO | disclosed |