Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 17/20 | 0.58 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2547045 | 0.88 | AVPR1A (0.60) | AVPR1AKCNH2AVPR2 | |
| SCHEMBL2547043 | 0.88 | AVPR1A (0.60) | AVPR1AKCNH2AVPR2 | |
| Hydrochloric Acid SCHEMBL2537572 | 0.87 | AVPR1A (0.59) | AVPR1AKCNH2AVPR2 | |
| Hydrochloric Acid SCHEMBL2537571 | 0.87 | AVPR1A (0.59) | AVPR1AKCNH2AVPR2 | |
| SCHEMBL2563653 | 0.81 | AVPR1A (0.63) | AVPR1AKCNH2AVPR2 | |
| SCHEMBL2562952 | 0.81 | AVPR1A (0.63) | AVPR1ACYP11B2KCNH2AVPR2 | |
| SCHEMBL2566714 | 0.80 | AVPR1A (0.71) | AVPR1ACYP11B2KCNH2AVPR2 | |
| SCHEMBL2565815 | 0.78 | AVPR1A (0.71) | AVPR1AKCNH2AVPR2 | |
| SCHEMBL2590525 | 0.77 | AVPR1A (0.58) | AVPR1ACYP11B2KCNH2HTR1ADRD2 | |
| SCHEMBL2594101 | 0.76 | AVPR1A (0.44) | AVPR1AKCNH2AVPR2 |
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 4 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 |
| EP-2571879-A1 | HETEROBIARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-03-27 | — | — | EP | disclosed |
| WO-2011134877-A1 | HETEROBIARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-11-03 | — | — | WO | disclosed |