Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 17/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6863363 | 0.96 | ADORA2A (0.47) | ADORA2AHSD11B1ADORA2BADORA1 | |
| SCHEMBL6863359 | 0.96 | ADORA2A (0.47) | ADORA2AHSD11B1ADORA2BADORA1 | |
| SCHEMBL6870243 | 0.88 | ADORA2A (0.44) | ADORA2AADORA2BADORA1 | |
| SCHEMBL6867753 | 0.86 | ADORA2A (0.61) | ADORA2A | |
| SCHEMBL6870280 | 0.86 | ADORA2A (0.53) | ADORA2A | |
| SCHEMBL6867359 | 0.85 | ADORA2A (0.62) | ADORA2A | |
| SCHEMBL6870218 | 0.84 | ADORA2A (0.45) | ADORA2A | |
| SCHEMBL6871877 | 0.84 | ADORA2A (0.48) | ADORA2A | |
| SCHEMBL6870494 | 0.82 | ADORA2A (0.53) | ADORA2AADORA2BADORA1 | |
| SCHEMBL6863814 | 0.82 | ADORA2A (0.67) | ADORA2AHSD11B1 |
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 |