Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 11/20 | 0.59 |
| ▸ | AVPR1A | P37288 | 7/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.56 |
| ▸ | OXTR | P30559 | 9/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL15234220 | 0.88 | OXTR (0.58) | AVPR2AVPR1AKCNH2OXTR | |
| SCHEMBL16774922 | 0.88 | AVPR2 (0.63) | AVPR2AVPR1AKCNH2OXTR | |
| SCHEMBL2510539 | 0.87 | OXTR (0.60) | AVPR2AVPR1AKCNH2OXTR | |
| SCHEMBL2510540 | 0.87 | OXTR (0.60) | AVPR2AVPR1AKCNH2OXTR | |
| SCHEMBL2511038 | 0.87 | OXTR (0.60) | AVPR2AVPR1AKCNH2OXTR | |
| SCHEMBL16774621 | 0.85 | AVPR2 (0.57) | AVPR2AVPR1AKCNH2OXTR | |
| SCHEMBL16774619 | 0.85 | AVPR2 (0.57) | AVPR2AVPR1AKCNH2OXTR | |
| SCHEMBL2509575 | 0.85 | AVPR1A (0.69) | AVPR2AVPR1AKCNH2OXTR | |
| SCHEMBL2510103 | 0.85 | AVPR1A (0.69) | AVPR2AVPR1AKCNH2OXTR | |
| SCHEMBL15234211 | 0.84 | OXTR (0.56) | AVPR2AVPR1AKCNH2OXTR |
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-2552919-A1 | ARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F. Hoffmann-La Roche AG (CH) | 2013-02-06 | — | — | EP | disclosed |
| WO-2011120877-A1 | ARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-10-06 | — | — | WO | disclosed |