Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 17/20 | 0.76 |
| ▸ | ADORA1 | P30542 | 16/20 | 0.76 |
| ▸ | ADORA3 | P0DMS8 | 7/20 | 0.63 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5017911 | 0.92 | ADORA2A (0.79) | ADORA2AADORA1ADORA3ADORA2BKDM4E | |
| SCHEMBL5017677 | 0.86 | ADORA2A (1.00) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL5017746 | 0.86 | ADORA2A (0.76) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL5016065 | 0.85 | ADORA2A (0.82) | ADORA2AADORA1ADORA3ADORA2BKDM4E | |
| SCHEMBL27661824 | 0.85 | ADORA2A (0.55) | ADORA2AADORA1ADORA3ADORA2BKDM4E | |
| SCHEMBL5016215 | 0.85 | ADORA2A (0.76) | ADORA2AADORA1ADORA3ADORA2BKDM4E | |
| SCHEMBL5016198 | 0.85 | ADORA2A (0.68) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL5612886 | 0.84 | ADORA2A (0.80) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL5022598 | 0.84 | ADORA2A (0.79) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL5017646 | 0.84 | ADORA2A (0.80) | 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 |
|---|---|---|---|---|---|---|---|
| CN-1953975-A | 2, 6 bisheteroaryl-4-aminopyrimidines as adenosine receptor antagonists | ALMIRALL PRODESFARMA AG (CH) | 2007-04-25 | — | — | CN | claimed |
| CN-1953975-A | 2, 6 bisheteroaryl-4-aminopyrimidines as adenosine receptor antagonists | ALMIRALL PRODESFARMA AG (CH) | 2007-04-25 | — | — | CN | disclosed |