Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ADORA2B | P29275 | 6/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.40 |
| ▸ | PDE4A | P27815 | 3/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.38 |
| ▸ | CNOT7 | Q9UIV1 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | PDE9A | O76083 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL5970424 | 0.84 | ADORA2B (0.40) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL5971083 | 0.82 | ATM (0.49) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL5970236 | 0.79 | ADORA2B (0.49) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL5970228 | 0.78 | ADORA2B (0.45) | KMT2AMEN1ADORA2BADORA3POLB | |
| SCHEMBL5970029 | 0.74 | ABL1 (0.43) | ADORA2BADORA3POLBADORA2APDE4A | |
| SCHEMBL5970321 | 0.74 | ADORA2A (0.47) | KMT2AMEN1ADORA2BADORA3ADORA2A | |
| SCHEMBL378878 | 0.70 | ADORA2B (0.58) | KMT2AMEN1ADORA2BADORA3ADORA2A | |
| SCHEMBL5970283 | 0.69 | MEN1 (0.41) | KMT2AMEN1POLBPDE4APDE4B | |
| SCHEMBL5970475 | 0.69 | ADORA2B (0.49) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL5971494 | 0.66 | GPR119 (0.45) | KMT2AMEN1ADORA2BADORA3ADORA2A |
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 |