Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 15/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 12/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 9/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 1/20 | 0.39 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.39 |
| ▸ | MAP3K20 | Q9NYL2 | 1/20 | 0.39 |
| ▸ | MAP4K5 | Q9Y4K4 | 1/20 | 0.39 |
| ▸ | MAPK11 | Q15759 | 4/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.36 |
| ▸ | GCGR | P47871 | 3/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 3/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3076305 | 0.85 | ADORA2B (0.52) | ADORA2BADORA1ADORA2AADORA3MAP4K4 | |
| SCHEMBL3063770 | 0.80 | ALDH1A1 (0.44) | ADORA2BADORA1ADORA2AADORA3 | |
| SCHEMBL3064528 | 0.79 | MAPK14 (0.53) | MAP4K4CSNK1DCLK4MAPK11MAPK14 | |
| SCHEMBL3063769 | 0.77 | ADORA2B (0.46) | ADORA2BADORA1ADORA2AADORA3MAPK11 | |
| SCHEMBL4697800 | 0.75 | CYP3A4 (0.41) | ADORA2BMAP4K4CSNK1DCLK4MAPK11 | |
| SCHEMBL3058158 | 0.73 | ADORA2B (0.44) | ADORA2BADORA1ADORA2AADORA3 | |
| SCHEMBL3063933 | 0.72 | BRAF (0.46) | ADORA2BADORA1ADORA2AADORA3 | |
| SCHEMBL3061780 | 0.72 | ADORA2B (0.54) | ADORA2BADORA1ADORA2AADORA3MAP4K4 | |
| SCHEMBL3073680 | 0.70 | METAP2 (0.46) | ADORA2BADORA1ADORA2AADORA3 | |
| SCHEMBL3064157 | 0.70 | CYP3A4 (0.44) | ADORA2BMAP4K4CSNK1DCLK4MAPK11 |
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-1922313-A1 | PYRAZINE DERIVATIVES USEFUL AS ADENOSINE RECEPTOR ANTAGONISTS | Laboratorios Almirall, S.A. (ES) | 2008-05-21 | — | — | EP | disclosed |
| WO-2007017096-A1 | PYRAZINE DERIVATIVES USEFUL AS ADENOSINE RECEPTOR ANTAGONISTS | LABORATORIOS ALMIRALL, S.A. (ES) | 2007-02-15 | — | — | WO | disclosed |