Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 20/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL6687026 | 0.82 | TACR1 (0.60) | TACR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL3343807 | 0.74 | HTR7 (0.41) | TACR1 | |
| SCHEMBL3339129 | 0.74 | ALDH1A1 (0.42) | TACR1CYP2D6 | |
| SCHEMBL13451788 | 0.65 | TACR1 (0.59) | TACR1 | |
| SCHEMBL5497673 | 0.64 | TACR1 (0.73) | TACR1 | |
| SCHEMBL13451453 | 0.64 | TACR1 (0.73) | TACR1 | |
| SCHEMBL6260036 | 0.64 | TACR1 (0.56) | TACR1CYP3A4 | |
| SCHEMBL5400717 | 0.63 | TACR1 (0.53) | TACR1CYP3A4 | |
| SCHEMBL6264741 | 0.63 | TACR1 (0.67) | TACR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL13272520 | 0.62 | TACR1 (0.73) | TACR1CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1472222-A1 | PIPERIDYLCARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF TACHYKINIM-MEDIATED DISEASES | GLAXO GROUP LIMITED (GB) | 2004-11-03 | — | — | EP | disclosed |
| WO-2003066589-A1 | PIPERIDYLCARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF TACHYKINIM-MEDIATED DISEASES | GLAXO GROUP LIMITED (GB) | 2003-08-14 | — | — | WO | disclosed |