Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 7/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.49 |
| ▸ | PDE4A | P27815 | 3/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.46 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.32 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5970236 | 0.76 | ADORA2B (0.49) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL378878 | 0.76 | ADORA2B (0.58) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL5971149 | 0.75 | ADORA2B (0.47) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL5970321 | 0.75 | ADORA2A (0.47) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL29429688 | 0.75 | ADORA2B (0.43) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL5971494 | 0.74 | GPR119 (0.45) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL5970088 | 0.73 | ALDH1A1 (0.51) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL6796625 | 0.72 | ADORA2B (0.48) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL5970424 | 0.71 | ADORA2B (0.40) | ADORA2BADORA2APDE4APDE4BPDE4C | |
| SCHEMBL5970228 | 0.71 | ADORA2B (0.45) | ADORA2BADORA2APDE4APDE4BPDE4C |
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-1658291-A2 | SUBSTITUTED 8-HETEROARYL XANTHINES | Adenosine Therapeutics, LLC (US) | 2006-05-24 | — | — | EP | disclosed |
| WO-2005021548-A2 | SUBSTITUTED 8-HETEROARYL XANTHINES | ADENOSINE THERAPEUTICS, LLC (US) | 2005-03-10 | — | — | WO | disclosed |