Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 20/20 | 0.68 |
| ▸ | ADORA2A | P29274 | 20/20 | 0.68 |
| ▸ | ADORA1 | P30542 | 19/20 | 0.68 |
| ▸ | ADORA2B | P29275 | 17/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL2167440 | 1.00 | ADORA3 (0.68) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL2167424 | 1.00 | ADORA3 (0.68) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL2170669 | 1.00 | ADORA3 (0.68) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL2170611 | 1.00 | ADORA3 (0.68) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL2167402 | 1.00 | ADORA3 (0.68) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL7224665 | 0.91 | ADORA3 (0.74) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL7224668 | 0.91 | ADORA3 (0.74) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL2168482 | 0.88 | ADORA3 (0.68) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL2168474 | 0.88 | ADORA3 (0.68) | ADORA3ADORA2AADORA1ADORA2B | |
| SCHEMBL2168478 | 0.88 | ADORA3 (0.68) | ADORA3ADORA2AADORA1ADORA2B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1904512-B1 | PURINE DERIVATIVES AS AGONISTS OF THE ADENOSINE A2A RECEPTOR | GLAXO GROUP LTD (GB) | 2012-06-20 | — | — | EP | claimed |
| US-7985740-B2 | anti-inflammatory; (2R,3S,4R,5R)-2-(2-ethyl-2H-tetrazol-5-yl)-5-[2-{[2-(1H-imidazol-4-yl)ethyl]amino}-6-({trans-4-[(2-{[2-(1H-imidazol-4-yl)ethyl]amino}-1H-purin-6-yl)amino]cyclohexyl}amino)-9H-purin-9-yl]tetrahydro-3,4-furandiol; immunosuppressive agents use in treatment of auto-immune diseases | GLAXO GROUP LIMITED (GB) | 2011-07-26 | — | — | US | claimed |
| EP-1904512-B1 | PURINE DERIVATIVES AS AGONISTS OF THE ADENOSINE A2A RECEPTOR | GLAXO GROUP LTD (GB) | 2012-06-20 | — | — | EP | disclosed |
| US-7985740-B2 | anti-inflammatory; (2R,3S,4R,5R)-2-(2-ethyl-2H-tetrazol-5-yl)-5-[2-{[2-(1H-imidazol-4-yl)ethyl]amino}-6-({trans-4-[(2-{[2-(1H-imidazol-4-yl)ethyl]amino}-1H-purin-6-yl)amino]cyclohexyl}amino)-9H-purin-9-yl]tetrahydro-3,4-furandiol; immunosuppressive agents use in treatment of auto-immune diseases | GLAXO GROUP LIMITED (GB) | 2011-07-26 | — | — | US | disclosed |