Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 2/20 | 0.33 |
| ▸ | CASP7 | P55210 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13628819 | 0.83 | CNR1 (0.43) | ADORA3ADORA2AADORA1ADORA2BALDH1A1 | |
| SCHEMBL2928554 | 0.78 | ADORA2A (0.39) | ADORA3ADORA2AADORA1ADORA2BALDH1A1 | |
| SCHEMBL13628837 | 0.78 | ADORA2A (0.39) | ADORA3ADORA2AADORA1ADORA2BALDH1A1 | |
| SCHEMBL13628825 | 0.70 | CYP1A2 (0.37) | ALDH1A1MAPTHPGDHSD17B10SMN1; SMN2 | |
| SCHEMBL13628832 | 0.65 | TRPC5 (0.38) | ALDH1A1KDM4EMAPTHPGDHSD17B10 | |
| SCHEMBL13628865 | 0.63 | RAB9A (0.35) | ADORA2AGAA | |
| SCHEMBL13628828 | 0.63 | ADORA3 (0.35) | ADORA3ADORA2AADORA1ADORA2BALDH1A1 | |
| SCHEMBL13628864 | 0.61 | CYP1A2 (0.39) | ALDH1A1HPGDHSD17B10SMN1; SMN2CASP1 | |
| SCHEMBL2928089 | 0.59 | ALDH1A1 (0.51) | ALDH1A1KDM4EMAPTHPGDHSD17B10 | |
| SCHEMBL30574744 | 0.57 | KDM4E (0.49) | ADORA3ADORA2AADORA1ADORA2BALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7612070-B2 | Heterocyclic compounds as antiinflammatory agents and cyclooxygenase inhibitors | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2009-11-03 | — | — | US | disclosed |