Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 20/20 | 0.75 |
| ▸ | ADORA1 | P30542 | 17/20 | 0.75 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.55 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL5016069 | 0.89 | ADORA2A (0.74) | ADORA2AADORA1KCNH2ADORA3ADORA2B | |
| SCHEMBL1489919 | 0.88 | ADORA2A (0.73) | ADORA2AADORA1KCNH2ADORA3ADORA2B | |
| SCHEMBL5022831 | 0.87 | ADORA2A (0.71) | ADORA2AADORA1KCNH2ADORA3ADORA2B | |
| SCHEMBL5022285 | 0.85 | ADORA2A (1.00) | ADORA2AADORA1KCNH2ADORA3ADORA2B | |
| SCHEMBL5022881 | 0.83 | ADORA2A (0.74) | ADORA2AADORA1KCNH2ADORA3ADORA2B | |
| SCHEMBL1489704 | 0.83 | ADORA2A (1.00) | ADORA2AADORA1KCNH2ADORA3ADORA2B | |
| SCHEMBL1489579 | 0.82 | ADORA2A (0.64) | ADORA2AADORA1KCNH2ADORA3ADORA2B | |
| SCHEMBL5016162 | 0.81 | ADORA2A (0.65) | ADORA2AADORA1KCNH2ADORA3ADORA2B | |
| SCHEMBL1489375 | 0.81 | ADORA2A (0.84) | ADORA2AADORA1KCNH2ADORA3ADORA2B | |
| SCHEMBL5016091 | 0.80 | ADORA2A (0.69) | ADORA2AADORA1ADORA3ADORA2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1697351-A1 | 2,6-BISHETEROARYL-4-AMINOPYRIMIDINES AS ADENOSINE RECEPTOR ANTAGONISTS | Almirall Prodesfarma AG (CH) | 2006-09-06 | — | — | EP | disclosed |
| WO-2005058883-A1 | 2, 6 BISHETEROARYL-4-AMINOPYRIMIDINES AS ADENOSINE RECEPTOR ANTAGONISTS | ALMIRALL PRODESFARMA AG (CH) | 2005-06-30 | — | — | WO | disclosed |