Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 4/20 | 0.61 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.56 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.55 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL1244504 | 1.00 | ADORA2A (0.61) | ADORA2AADORA2BADORA3ADORA1 | |
| SCHEMBL10457883 | 1.00 | ADORA2A (0.61) | ADORA2AADORA2BADORA3ADORA1 | |
| SCHEMBL12731388 | 1.00 | ADORA2A (0.61) | ADORA2AADORA2BADORA3ADORA1 | |
| SCHEMBL1245074 | 0.94 | ADORA2A (0.64) | ADORA2AADORA2BADORA3ADORA1 | |
| SCHEMBL10458873 | 0.94 | ADORA2A (0.64) | ADORA2AADORA2BADORA3ADORA1 | |
| SCHEMBL13612209 | 0.94 | ADORA2A (0.62) | ADORA2AADORA2BADORA3ADORA1 | |
| SCHEMBL14393650 | 0.94 | ADORA2A (0.60) | ADORA2AADORA2BADORA3ADORA1 | |
| SCHEMBL1244389 | 0.94 | ADORA2A (0.62) | ADORA2AADORA2BADORA3ADORA1 | |
| SCHEMBL1244335 | 0.94 | ADORA2A (0.60) | ADORA2AADORA2BADORA3ADORA1 | |
| SCHEMBL10456283 | 0.94 | ADORA2A (0.64) | ADORA2AADORA2BADORA3ADORA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8222228-B2 | Substituted aryl piperidinylalkynyladenosines as A2AR agonists | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2012-07-17 | — | — | US | disclosed |
| US-7888329-B2 | Substituted aryl piperidinylalkynyladenosines as A2AR agonists | PGXHEALTH, LLC (US) | 2011-02-15 | — | — | US | disclosed |
| US-7589076-B2 | Substituted aryl piperidinylalkynyladenosines as A2AR agonists | PGX HEALTH, LLC (US) | 2009-09-15 | — | — | US | disclosed |