Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 9/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 9/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.42 |
| ▸ | TSHR | P16473 | 7/20 | 0.42 |
| ▸ | USP2 | O75604 | 5/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5970462 | 0.88 | ADORA2B (0.52) | ATMADORA2BLMNAHIF1AMEN1 | |
| SCHEMBL5970460 | 0.83 | NPC1 (0.48) | ADORA2BHSD17B10CLK4MAPK1ALDH1A1 | |
| SCHEMBL5970324 | 0.82 | ATM (0.47) | ATMADORA2BCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5970231 | 0.79 | ADORA2B (0.56) | ADORA2BCLK4HPSE | |
| SCHEMBL5970144 | 0.79 | ADORA2B (0.47) | ADORA2BALDH1A1GAAMEN1KMT2A | |
| SCHEMBL5970239 | 0.78 | ADORA2B (0.51) | ADORA2BLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL5970162 | 0.78 | ADORA2B (0.49) | ADORA2BCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL5970230 | 0.77 | ADORA2B (0.48) | ADORA2BALDH1A1GAAHPSENPC1 | |
| SCHEMBL1497302 | 0.77 | ADORA2B (0.66) | ADORA2BCYP1A2CYP3A4CYP2C19HSD17B10 | |
| SCHEMBL5971321 | 0.77 | ADORA2B (0.48) | ADORA2BHSD17B10TSHRLMNATP53 |
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 | claimed |
| WO-2005021548-A2 | SUBSTITUTED 8-HETEROARYL XANTHINES | ADENOSINE THERAPEUTICS, LLC (US) | 2005-03-10 | — | — | WO | claimed |