Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 8/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 2/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 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 | |
|---|---|---|---|---|
| SCHEMBL14865327 | 0.90 | RAB9A (0.40) | P2RX7CNR2BACE1PTGES | |
| SCHEMBL2807472 | 0.89 | P2RX7 (0.39) | TRPA1P2RX7CNR2HDAC3HDAC1 | |
| Hydrochloric Acid SCHEMBL2805225 | 0.88 | P2RX7 (0.39) | TRPA1P2RX7CNR2HDAC3HDAC1 | |
| SCHEMBL2782482 | 0.86 | P2RX7 (0.38) | TRPA1P2RX7CNR2HDAC3HDAC1 | |
| SCHEMBL2812751 | 0.85 | P2RX7 (0.37) | TRPA1P2RX7CNR2HDAC3HDAC1 | |
| SCHEMBL19418572 | 0.85 | CNR2 (0.38) | TRPA1P2RX7CNR2HDAC3HDAC1 | |
| SCHEMBL19418558 | 0.85 | TRPA1 (0.37) | TRPA1P2RX7CNR2HDAC3HDAC1 | |
| SCHEMBL2805100 | 0.83 | CNR2 (0.37) | TRPA1P2RX7CNR2AURKAOPRL1 | |
| SCHEMBL2809823 | 0.83 | CNR2 (0.37) | TRPA1P2RX7CNR2AURKAOPRL1 | |
| SCHEMBL13160253 | 0.83 | TRPA1 (0.36) | TRPA1P2RX7CNR2BACE1NTRK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2401256-B1 | Compounds as bradykinin B1 antagonists | BOEHRINGER INGELHEIM INT (DE) | 2013-04-17 | — | — | EP | disclosed |