Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 20/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 19/20 | 0.51 |
| ▸ | ADORA1 | P30542 | 12/20 | 0.51 |
| ▸ | ADORA2B | P29275 | 11/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4218007 | 1.00 | ADORA2A (0.51) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL4218009 | 0.96 | ADORA2A (0.51) | ADORA2AADORA3ADORA1ADORA2B | |
| Trifluoroacetic Acid SCHEMBL4218003 | 0.92 | ADORA2A (0.59) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL3907222 | 0.92 | ADORA3 (0.44) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL4228178 | 0.88 | ADORA2A (0.44) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL3907225 | 0.87 | ADORA3 (0.44) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL3904406 | 0.87 | ADORA1 (0.41) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL4220393 | 0.85 | ADORA3 (0.43) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL4220346 | 0.85 | ADORA3 (0.46) | ADORA2AADORA3ADORA1ADORA2B | |
| Trifluoroacetic Acid SCHEMBL3907220 | 0.85 | ADORA3 (0.51) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2018381-A2 | USE OF 2-(PURIN-9-YL)-TETRAHYDOFURAN-3,4-DIOL DERIVATIVES AS ADENOSINE A2A RECEPTOR AGONISTS | Novartis AG (CH) | 2009-01-28 | — | — | EP | disclosed |
| WO-2007121918-A2 | USE OF 2-(PURIN-9-YL)-TETRAHYDOFURAN-3,4-DIOL DERIVATIVES AS ADENOSINE A2A RECEPTOR AGONISTS | NOVARTIS AG (CH) | 2007-11-01 | — | — | WO | disclosed |