Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | BDKRB1 | P46663 | 4/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9892777 | 0.85 | PTGES (0.34) | BDKRB1CNR1TRPV1 | |
| SCHEMBL2805106 | 0.80 | AURKA (0.35) | HDAC6CNR1 | |
| SCHEMBL2806442 | 0.79 | P2RX7 (0.33) | CNR1 | |
| SCHEMBL10070731 | 0.79 | EPHX2 (0.38) | — | |
| SCHEMBL2807318 | 0.78 | BDKRB1 (0.39) | BDKRB1TRPV1 | |
| SCHEMBL19418557 | 0.77 | OPRL1 (0.33) | — | |
| SCHEMBL2808594 | 0.74 | OPRL1 (0.36) | BDKRB1 | |
| SCHEMBL14856801 | 0.73 | TRPV1 (0.34) | BDKRB1CNR1TRPV1 | |
| SCHEMBL15460053 | 0.73 | OPRL1 (0.34) | HDAC6 | |
| SCHEMBL16404399 | 0.73 | ROCK2 (0.33) | BDKRB1CNR1 |
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 |