Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 12/20 | 0.75 |
| ▸ | AVPR1A | P37288 | 12/20 | 0.75 |
| ▸ | OXTR | P30559 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL8317058 | 0.91 | AVPR2 (0.74) | AVPR2AVPR1AOXTR | |
| SCHEMBL8313571 | 0.89 | AVPR2 (0.73) | AVPR2AVPR1AOXTR | |
| SCHEMBL8314609 | 0.87 | AVPR2 (0.79) | AVPR2AVPR1AOXTR | |
| SCHEMBL8314772 | 0.87 | AVPR2 (0.60) | AVPR2AVPR1AOXTR | |
| SCHEMBL8317809 | 0.87 | AVPR2 (0.77) | AVPR2AVPR1A | |
| SCHEMBL8313800 | 0.86 | AVPR2 (0.78) | AVPR2AVPR1AOXTR | |
| SCHEMBL7332865 | 0.86 | AVPR2 (1.00) | AVPR2AVPR1AOXTR | |
| SCHEMBL8474627 | 0.84 | AVPR2 (0.71) | AVPR2AVPR1AOXTR | |
| SCHEMBL8316379 | 0.82 | AVPR2 (0.77) | AVPR2AVPR1AOXTR | |
| SCHEMBL8313271 | 0.82 | AVPR2 (0.77) | AVPR2AVPR1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0630887-B1 | 4-(aryl-substituted)-piperidines as neurokinin receptor antagonists | ZENECA LTD (GB) | 1999-07-28 | — | — | EP | disclosed |
| EP-0636625-B1 | Tricyclic diazepines vasopressin and oxytocin antagonists | AMERICAN CYANAMID CO (US) | 1999-01-27 | — | — | EP | disclosed |
| EP-0630887-A1 | 4-(aryl-substituted)-piperidines as neurokinin receptor antagonists | ZENECA LIMITED (GB) | 1994-12-28 | — | — | EP | disclosed |