Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 4/20 | 0.33 |
| ▸ | OXTR | P30559 | 1/20 | 0.31 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2563008 | 0.89 | AVPR1A (0.36) | AVPR2AVPR1A | |
| SCHEMBL2564607 | 0.80 | AVPR1A (0.35) | AVPR1A | |
| SCHEMBL14844442 | 0.80 | AVPR1A (0.35) | AVPR1A | |
| SCHEMBL2547669 | 0.80 | AVPR1A (0.35) | AVPR2AVPR1A | |
| SCHEMBL2566037 | 0.79 | AVPR2 (0.34) | AVPR2 | |
| SCHEMBL2577744 | 0.78 | OXTR (0.35) | AVPR2OXTRAVPR1A | |
| SCHEMBL2561816 | 0.77 | AVPR1A (0.36) | AVPR2AVPR1A | |
| SCHEMBL2475282 | 0.76 | AVPR1A (0.38) | AVPR2AVPR1A | |
| SCHEMBL2566582 | 0.74 | AVPR2 (0.32) | AVPR2 | |
| SCHEMBL2542067 | 0.74 | AVPR1A (0.54) | AVPR2OXTRAVPR1A |
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-2560975-A1 | HETEROARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES AS VASOPRESSIN V1A RECEPTOR ANTAGONISTS | F. Hoffmann-La Roche AG (CH) | 2013-02-27 | — | — | EP | disclosed |
| WO-2011131596-A1 | HETEROARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES AS VASOPRESSIN V1A RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-10-27 | — | — | WO | disclosed |