Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RY1 | P47900 | 13/20 | 0.83 |
| ▸ | P2RY2 | P41231 | 4/20 | 0.71 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.59 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.59 |
| ▸ | HSP90B1 | P14625 | 2/20 | 0.59 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.59 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.59 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.59 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.59 |
| ▸ | P2RY11 | Q96G91 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL12269663 | 0.91 | P2RY1 (1.00) | P2RY1P2RY2ADORA3HSP90AA1HSP90B1 | |
| SCHEMBL14346778 | 0.91 | P2RY1 (1.00) | P2RY1P2RY2ADORA3HSP90AA1HSP90B1 | |
| SCHEMBL10120961 | 0.91 | P2RY1 (1.00) | P2RY1P2RY2ADORA3HSP90AA1HSP90B1 | |
| SCHEMBL19464862 | 0.91 | P2RY1 (1.00) | P2RY1P2RY2ADORA3HSP90AA1HSP90B1 | |
| SCHEMBL14346823 | 0.89 | P2RY1 (0.83) | P2RY1P2RY2ADORA3HSP90AA1HSP90B1 | |
| SCHEMBL8230100 | 0.86 | P2RY1 (0.85) | P2RY1P2RY2ADORA3HSP90AA1HSP90B1 | |
| SCHEMBL19459900 | 0.84 | P2RY1 (0.98) | P2RY1P2RY2ADORA3HSP90AA1HSP90B1 | |
| SCHEMBL19464861 | 0.83 | P2RY1 (1.00) | P2RY1P2RY2ADORA3HSP90AA1HSP90B1 | |
| SCHEMBL19415062 | 0.82 | P2RY1 (0.83) | P2RY1P2RY2ADORA3HSP90AA1HSP90B1 | |
| SCHEMBL21710861 | 0.82 | P2RY1 (0.83) | P2RY1P2RY2ADORA3HSP90AA1HSP90B1 |
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-2049127-B1 | N-METHANOCARBA DERIVATIVES TO TREAT CARDIAC DISEASES | UNIV CONNECTICUT (US) | 2014-11-26 | — | — | EP | disclosed |