Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 3/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | NT5E | P21589 | 5/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL4230273 | 0.90 | ADORA1 (0.70) | ADORA1ADORA3ADORA2AADORA2B | |
| SCHEMBL3913337 | 0.90 | ADORA1 (0.70) | ADORA1ADORA3ADORA2AADORA2B | |
| SCHEMBL2809155 | 0.90 | ADORA1 (0.70) | ADORA1ADORA3ADORA2AADORA2B | |
| SCHEMBL2832621 | 0.90 | ADORA1 (0.70) | ADORA1ADORA3ADORA2AADORA2B | |
| SCHEMBL6841629 | 0.89 | ADORA3 (0.44) | ADORA1ADORA3NT5EADORA2A | |
| SCHEMBL4618979 | 0.84 | ADORA1 (0.72) | ADORA1ADORA3NT5EADORA2AADORA2B | |
| SCHEMBL6839834 | 0.83 | ADORA3 (0.68) | ADORA1ADORA3ADORA2A | |
| SCHEMBL6876893 | 0.81 | ADORA1 (0.56) | ADORA1ADORA3NT5EADORA2AADORA2B | |
| SCHEMBL6841625 | 0.80 | ADORA2A (0.56) | ADORA1ADORA3ADORA2AADORA2B | |
| SCHEMBL3904406 | 0.79 | ADORA1 (0.41) | ADORA1ADORA3ADORA2AADORA2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6762170-B1 | ANTIINFLAMMATORY AGENTS INHIBIT LEUKOCYTE RECRUITMENT AND ACTIVATION AND ARE AGONISTS OF THE ADENOSINE 2A RECEPTOR; PENDANT ISOXAZOLE; REACTING A 2,6-DIAMINOPURINE WITH A 2-(3-SUBSTITUTED ISOXAZOL-5-YL)TETRAHYDROFURAN-3,4-DIOL | SMITHKLINEBEECHAM CORPORATION | 2004-07-13 | — | — | US | disclosed |
| EP-1051425-B1 | 2-(PURIN-9-yl)-TETRAHYDROFURAN-3,4-DIOL DERIVATIVES | GLAXO GROUP LTD (GB) | 2002-10-30 | — | — | EP | disclosed |