Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 15/20 | 0.67 |
| ▸ | ADORA1 | P30542 | 12/20 | 0.67 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.58 |
| ▸ | ADORA2B | P29275 | 4/20 | 0.58 |
| ▸ | BRD4 | O60885 | 2/20 | 0.48 |
| ▸ | KDM6B | O15054 | 2/20 | 0.38 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5023064 | 0.86 | ADORA2A (0.62) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL5016065 | 0.85 | ADORA2A (0.82) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL5016210 | 0.85 | ADORA2A (0.64) | ADORA2AADORA1ADORA3ADORA2BBRD4 | |
| SCHEMBL5022492 | 0.84 | ADORA2A (0.64) | ADORA2AADORA1ADORA3ADORA2BBRD4 | |
| SCHEMBL5016182 | 0.83 | ADORA2A (0.59) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL1489916 | 0.82 | ADORA2A (0.77) | ADORA2AADORA1ADORA3ADORA2BKDM6B | |
| SCHEMBL5016229 | 0.81 | ADORA2A (0.68) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL5022906 | 0.81 | ADORA2A (0.77) | ADORA2AADORA1ADORA3ADORA2BBRD4 | |
| SCHEMBL5022844 | 0.80 | ADORA2A (0.73) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL5017677 | 0.80 | ADORA2A (1.00) | 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 |