Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.38 |
| ▸ | P2RY12 | Q9H244 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL3166495 | 0.93 | SLC1A2 (0.44) | ADORA2AADORA1ADORA2BADORA3SLC1A2 | |
| SCHEMBL3164788 | 0.89 | LMNA (0.49) | CHRM4DRD2ADRA1ADRD3ALDH1A1 | |
| SCHEMBL3174104 | 0.88 | ADORA2A (0.41) | ADORA2AADORA1ADORA2BADORA3SLC1A2 | |
| SCHEMBL3162484 | 0.88 | MAPT (0.44) | ADORA2AADORA1ADORA2BADORA3CHRM4 | |
| SCHEMBL3164671 | 0.88 | ADORA2A (0.41) | ADORA2AADORA1ADORA2BADORA3SLC1A2 | |
| SCHEMBL3155601 | 0.88 | ADORA2A (0.42) | ADORA2AADORA1ADORA2BADORA3SLC1A2 | |
| SCHEMBL3163864 | 0.87 | LMNA (0.43) | ADORA2AADORA1ADORA2BADORA3ALDH1A1 | |
| SCHEMBL3165279 | 0.87 | CYP1A2 (0.43) | ADORA2AADORA1ADORA2BADORA3P2RY12 | |
| SCHEMBL3175769 | 0.86 | ADORA2A (0.45) | ADORA2AADORA1ADORA2BADORA3P2RY12 | |
| SCHEMBL3156095 | 0.86 | SLC1A2 (0.46) | ADORA2AADORA1ADORA2BADORA3SLC1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1465631-B1 | PYRIMIDINE A2B SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE | OSI PHARM INC (US) | 2010-02-24 | — | — | EP | disclosed |