Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 18/20 | 0.57 |
| ▸ | ADORA2A | P29274 | 16/20 | 0.57 |
| ▸ | ADORA1 | P30542 | 13/20 | 0.57 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5191233 | 0.88 | ADORA2B (0.56) | ADORA2BADORA2AADORA1ADORA3 | |
| SCHEMBL5189470 | 0.87 | ADORA2B (0.47) | ADORA2BADORA2AADORA1ADORA3BACE1 | |
| SCHEMBL5193496 | 0.87 | ADORA2A (0.45) | ADORA2BADORA2AADORA1BACE1USP2 | |
| SCHEMBL5190652 | 0.86 | ADORA2B (0.47) | ADORA2BADORA2AADORA1ADORA3BACE1 | |
| SCHEMBL5189219 | 0.86 | ADORA2B (0.47) | ADORA2BADORA2AADORA1ADORA3BACE1 | |
| SCHEMBL5189431 | 0.85 | ADORA2B (0.54) | ADORA2BADORA2AADORA1ADORA3 | |
| SCHEMBL5191581 | 0.84 | ADORA2B (0.45) | ADORA2BADORA2AADORA1ADORA3BACE1 | |
| SCHEMBL5191811 | 0.83 | ADORA2B (0.44) | ADORA2BADORA2AADORA1ADORA3BACE1 | |
| SCHEMBL5189529 | 0.83 | ADORA2B (0.42) | ADORA2BADORA2AADORA1BACE1USP2 | |
| SCHEMBL1553887 | 0.83 | ADORA2A (0.53) | ADORA2BADORA2AADORA1ADORA3 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1439176-B1 | PYRIMIDONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | EISAI R&D MAN CO LTD (JP) | 2007-03-21 | — | — | EP | disclosed |
| EP-1439176-B1 | PYRIMIDONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | EISAI R&D MAN CO LTD (JP) | 2007-03-21 | — | — | EP | disclosed |
| US-7160892-B2 | Pyrimidone compounds and pharmaceutical compositions containing the same | EISAI CO., LTD. (JP) | 2007-01-09 | — | — | US | disclosed |
| US-7160892-B2 | Pyrimidone compounds and pharmaceutical compositions containing the same | EISAI CO., LTD. (JP) | 2007-01-09 | — | — | US | disclosed |
| US-7160892-B2 | Pyrimidone compounds and pharmaceutical compositions containing the same | EISAI CO., LTD. (JP) | 2007-01-09 | — | — | US | disclosed |
| EP-1439176-A1 | PYRIMIDONE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | Eisai Co., Ltd. (JP) | 2004-07-21 | — | — | EP | disclosed |