Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 19/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 8/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL589052 | 1.00 | ADORA2A (0.42) | ADORA2AADORA3ADORA1ADORA2BEPHX2 | |
| SCHEMBL589051 | 1.00 | ADORA2A (0.42) | ADORA2AADORA3ADORA1ADORA2BEPHX2 | |
| Hydrochloric Acid SCHEMBL589442 | 0.99 | ADORA2A (0.41) | ADORA2AADORA3ADORA1ADORA2BEPHX2 | |
| Hydrochloric Acid SCHEMBL589441 | 0.99 | ADORA2A (0.41) | ADORA2AADORA3ADORA1ADORA2BEPHX2 | |
| SCHEMBL590749 | 0.96 | ADORA2A (0.39) | ADORA2AADORA3ADORA1ADORA2BEPHX2 | |
| SCHEMBL590748 | 0.96 | ADORA2A (0.39) | ADORA2AADORA3ADORA1ADORA2BEPHX2 | |
| SCHEMBL11968391 | 0.96 | ADORA2A (0.43) | ADORA2AADORA3ADORA1 | |
| SCHEMBL2812113 | 0.96 | ADORA2A (0.43) | ADORA2AADORA3ADORA1 | |
| SCHEMBL2812110 | 0.96 | ADORA2A (0.43) | ADORA2AADORA3ADORA1 | |
| Hydrochloric Acid SCHEMBL589597 | 0.93 | ADORA2A (0.42) | ADORA2AADORA3ADORA1ADORA2B |
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-1841768-B1 | PURINE DERIVATIVES ACTING AS A2A RECEPTOR AGONISTS | NOVARTIS AG (CH) | 2008-11-12 | — | — | EP | disclosed |