Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 4/20 | 0.32 |
| ▸ | AVPR2 | P30518 | 2/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2579842 | 0.86 | AVPR1A (0.31) | AVPR1A | |
| SCHEMBL2586788 | 0.85 | OXTR (0.32) | AVPR1AAVPR2KCNH2 | |
| SCHEMBL2563008 | 0.84 | AVPR1A (0.36) | AVPR1AAVPR2KCNH2 | |
| SCHEMBL2563323 | 0.78 | AVPR1A (0.33) | AVPR1A | |
| SCHEMBL2561816 | 0.77 | AVPR1A (0.36) | AVPR1AAVPR2KCNH2 | |
| SCHEMBL2563133 | 0.77 | CBLB (0.32) | AVPR1A | |
| SCHEMBL2552411 | 0.77 | AVPR1A (0.34) | AVPR1AKCNH2 | |
| SCHEMBL2475282 | 0.76 | AVPR1A (0.38) | AVPR1AAVPR2KCNH2 | |
| SCHEMBL2560012 | 0.76 | AVPR1A (0.32) | AVPR1AAVPR2KCNH2 | |
| SCHEMBL2346991 | 0.76 | SLC6A4 (0.32) | AVPR1AAVPR2KCNH2 |
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-2571879-A1 | HETEROBIARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-03-27 | — | — | EP | claimed |
| WO-2011134877-A1 | HETEROBIARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-11-03 | — | — | WO | claimed |