Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 13/20 | 0.37 |
| ▸ | AVPR2 | P30518 | 9/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.37 |
| ▸ | OXTR | P30559 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2551680 | 0.78 | OPRK1 (0.34) | AVPR1A | |
| SCHEMBL2552411 | 0.75 | AVPR1A (0.34) | AVPR1AKCNH2 | |
| SCHEMBL2567189 | 0.75 | AVPR1A (0.38) | AVPR1A | |
| Hydrochloric Acid SCHEMBL2563942 | 0.74 | AVPR1A (0.37) | AVPR1A | |
| SCHEMBL2564920 | 0.73 | AVPR1A (0.35) | AVPR1A | |
| SCHEMBL2556524 | 0.72 | CYP11B2 (0.32) | AVPR1AAVPR2KCNH2 | |
| SCHEMBL2565904 | 0.72 | AVPR2 (0.37) | AVPR1AAVPR2KCNH2OXTR | |
| SCHEMBL2590577 | 0.71 | AVPR1A (0.32) | AVPR1AAVPR2KCNH2 | |
| SCHEMBL2563262 | 0.71 | CYP11B2 (0.41) | AVPR1A | |
| SCHEMBL2579657 | 0.71 | OXTR (0.36) | AVPR1AAVPR2KCNH2OXTR |
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 |