Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 17/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6863099 | 0.85 | ADORA2A (0.45) | ADORA2AADORA3ADORA1 | |
| SCHEMBL6871212 | 0.83 | ALDH1A1 (0.48) | ADORA2A | |
| SCHEMBL6867154 | 0.81 | ADORA2A (0.63) | ADORA2AADORA3ADORA2BADORA1 | |
| SCHEMBL6869842 | 0.80 | PLAU (0.48) | ADORA2A | |
| SCHEMBL6870530 | 0.80 | ADORA2A (0.43) | ADORA2AADORA3ADORA2BADORA1 | |
| SCHEMBL6869244 | 0.80 | ADORA2A (0.67) | ADORA2A | |
| SCHEMBL6867888 | 0.79 | ADORA2A (0.66) | ADORA2AADORA3ADORA2BADORA1 | |
| SCHEMBL6870631 | 0.79 | LMNA (0.48) | ADORA2AADORA3ADORA2BADORA1 | |
| SCHEMBL6871623 | 0.79 | ADORA2A (0.67) | ADORA2A | |
| SCHEMBL6863797 | 0.78 | ADORA2A (0.50) | ADORA2AADORA3ADORA2BADORA1 |
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 |