Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 15/20 | 0.63 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6863797 | 0.89 | ADORA2A (0.50) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL6870143 | 0.84 | ADORA2A (0.65) | ADORA2AALDH1A1HPGD | |
| SCHEMBL6863099 | 0.83 | ADORA2A (0.45) | ADORA2AADORA1ADORA3 | |
| SCHEMBL6870638 | 0.82 | ADORA2A (0.55) | ADORA2AALDH1A1HPGD | |
| SCHEMBL6871806 | 0.81 | ADORA2A (0.42) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL6863309 | 0.80 | ADORA2A (0.69) | ADORA2AADORA1ADORA3ADORA2BALDH1A1 | |
| SCHEMBL6869813 | 0.80 | ADORA2A (0.44) | ADORA2AHPGD | |
| SCHEMBL6870530 | 0.79 | ADORA2A (0.43) | ADORA2AADORA1ADORA3ADORA2BALDH1A1 | |
| SCHEMBL6863498 | 0.78 | ADORA2A (0.79) | ADORA2AALDH1A1 | |
| SCHEMBL6863691 | 0.77 | ADORA2A (0.71) | ADORA2A |
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-1347974-B1 | AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | disclosed |