Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 20/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 10/20 | 0.53 |
| ▸ | AVPR2 | P30518 | 8/20 | 0.53 |
| ▸ | OXTR | P30559 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3332665 | 0.85 | AVPR1A (0.63) | AVPR1AKCNH2AVPR2 | |
| SCHEMBL3336066 | 0.82 | AVPR1A (0.77) | AVPR1AKCNH2AVPR2 | |
| SCHEMBL13300141 | 0.82 | AVPR1A (0.77) | AVPR1AKCNH2AVPR2 | |
| SCHEMBL2474997 | 0.82 | AVPR1A (0.77) | AVPR1AKCNH2AVPR2 | |
| SCHEMBL3332451 | 0.82 | AVPR1A (0.77) | AVPR1AKCNH2AVPR2 | |
| SCHEMBL7899591 | 0.81 | AVPR1A (0.51) | AVPR1AKCNH2AVPR2 | |
| SCHEMBL3327242 | 0.79 | AVPR1A (0.64) | AVPR1AKCNH2AVPR2OXTR | |
| SCHEMBL3327094 | 0.79 | AVPR1A (0.66) | AVPR1AKCNH2AVPR2 | |
| SCHEMBL15233987 | 0.77 | AVPR1A (0.59) | AVPR1AKCNH2AVPR2OXTR | |
| SCHEMBL15234146 | 0.77 | AVPR1A (0.59) | AVPR1AKCNH2AVPR2OXTR |
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-2010060836-A1 | ARYLCYCLOHEXYLETHERS OF DIHYDROTETRAAZABENZOAZULENES FOR USE AS VASOPRESSIN VIA RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-06-03 | — | — | WO | disclosed |