Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 17/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6870499 | 0.89 | ADORA2A (0.59) | ADORA2A | |
| SCHEMBL6863079 | 0.89 | ADORA2A (0.42) | ADORA2A | |
| SCHEMBL6871231 | 0.88 | ADORA2A (0.45) | ADORA2A | |
| SCHEMBL6873639 | 0.83 | ADORA2A (0.46) | ADORA2A | |
| SCHEMBL6867741 | 0.82 | ADORA2A (0.46) | ADORA2AHDAC1HDAC6 | |
| SCHEMBL6871395 | 0.82 | ADORA2A (0.48) | ADORA2A | |
| SCHEMBL6871970 | 0.79 | ADORA2A (0.43) | ADORA2AHDAC1HDAC6 | |
| SCHEMBL6871621 | 0.77 | CAMK2D (0.40) | ADORA2AHDAC1HDAC6 | |
| SCHEMBL6863797 | 0.77 | ADORA2A (0.50) | ADORA2A | |
| SCHEMBL6869794 | 0.77 | ADORA2A (0.59) | ADORA2A |
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-1347974-B1 | AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | disclosed |
| US-6506772-B1 | Pharmaceutically active salts thereof with activity as adenosine receptor ligands are disclosed. These compounds are the adenosine receptor. | HOFFMANN-LA ROCHE INC. | 2003-01-14 | — | — | US | disclosed |