Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 16/20 | 0.57 |
| ▸ | ADORA3 | P0DMS8 | 9/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.53 |
| ▸ | NT5E | P21589 | 3/20 | 0.47 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL242564 | 1.00 | ADORA2A (0.57) | ADORA2AADORA3ADORA1NT5EADORA2B | |
| SCHEMBL242565 | 1.00 | ADORA2A (0.57) | ADORA2AADORA3ADORA1NT5EADORA2B | |
| SCHEMBL293370 | 1.00 | ADORA2A (0.57) | ADORA2AADORA3ADORA1NT5EADORA2B | |
| SCHEMBL241874 | 0.90 | ADORA2A (0.58) | ADORA2AADORA3ADORA1NT5EADORA2B | |
| SCHEMBL1402047 | 0.89 | ADORA2A (0.69) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL12003311 | 0.89 | ADORA2A (0.69) | ADORA2AADORA3ADORA1ADORA2B | |
| SCHEMBL242860 | 0.88 | ADORA2A (0.45) | ADORA2AADORA3NT5E | |
| SCHEMBL242859 | 0.88 | ADORA2A (0.45) | ADORA2AADORA3NT5E | |
| SCHEMBL238564 | 0.88 | ADORA2A (0.60) | ADORA2AADORA3ADORA1NT5EADORA2B | |
| SCHEMBL1844827 | 0.87 | ADORA2A (0.57) | ADORA2AADORA3ADORA1NT5E |
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-2013211-B1 | PURINE DERIVATIVES FOR USE AS ADENOSIN A2A RECEPTOR AGONISTS | NOVARTIS AG (CH) | 2012-03-14 | — | — | EP | disclosed |