Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 8/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 7/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.49 |
| ▸ | PDE4A | P27815 | 4/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.49 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5970321 | 0.83 | ADORA2A (0.47) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL5970029 | 0.83 | ABL1 (0.43) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL5970228 | 0.81 | ADORA2B (0.45) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL5970424 | 0.81 | ADORA2B (0.40) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL5970280 | 0.79 | KMT2A (0.46) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL5971083 | 0.77 | ATM (0.49) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL5970475 | 0.76 | ADORA2B (0.49) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL378878 | 0.72 | ADORA2B (0.58) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL5971149 | 0.72 | ADORA2B (0.47) | ADORA2BADORA3ADORA2APDE4APDE4B | |
| SCHEMBL29429688 | 0.71 | ADORA2B (0.43) | ADORA2BADORA3ADORA2APDE4APDE4B |
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 |