Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 18/20 | 0.61 |
| ▸ | CCR3 | P51677 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8921126 | 0.94 | TACR1 (0.55) | TACR1CCR3SLC6A4 | |
| SCHEMBL8669200 | 0.90 | TACR1 (0.60) | TACR1CCR3 | |
| SCHEMBL8921168 | 0.89 | TACR1 (0.61) | TACR1CCR3 | |
| SCHEMBL8673223 | 0.89 | TACR1 (0.61) | TACR1CCR3 | |
| SCHEMBL8673617 | 0.87 | TACR1 (0.49) | TACR1CCR3SLC6A4 | |
| SCHEMBL8671453 | 0.87 | TACR1 (0.60) | TACR1CCR3 | |
| SCHEMBL8673188 | 0.86 | TACR1 (0.50) | TACR1 | |
| SCHEMBL8671580 | 0.85 | TACR1 (0.49) | TACR1 | |
| SCHEMBL8673191 | 0.83 | TACR1 (0.48) | TACR1 | |
| SCHEMBL8671174 | 0.83 | TACR1 (0.48) | TACR1 |
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-5696123-A | ALPHA-PIPERAZINYL BENZYL COMPOUND AS TACHYKININ ANTAGONIST TREATING ASTHMA, BRONCHITIS, SKIN DISORDER, EYE DISEASE, HEADACHE, GASTROINTESTINAL DISORDER | BOEHRINGER INGELHEIM KG (DE) | 1997-12-09 | — | — | US | disclosed |