Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 7/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | CASP1 | P29466 | 2/20 | 0.35 |
| ▸ | CASP7 | P55210 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 7/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.34 |
| ▸ | AKT1 | P31749 | 3/20 | 0.34 |
| ▸ | MTOR | P42345 | 3/20 | 0.34 |
| ▸ | GRM1 | Q13255 | 3/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3227759 | 0.95 | ALDH1A1 (0.39) | ADORA1ALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7938180 | 0.79 | AKT1 (0.41) | ALDH1A1CYP1A2CYP3A4CYP2C9HPGD | |
| SCHEMBL7938054 | 0.79 | AKT1 (0.41) | ADORA1ALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7947925 | 0.79 | ADORA1 (0.36) | ADORA1ADORA2AADORA3ADORA2BHSP90AA1 | |
| SCHEMBL7946737 | 0.78 | ALDH1A1 (0.36) | ADORA1ALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3227758 | 0.77 | CYP1A2 (0.41) | ADORA1ALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7938419 | 0.77 | AKT1 (0.41) | ALDH1A1CYP1A2CYP3A4CYP2C9HPGD | |
| SCHEMBL7938052 | 0.77 | CCND1 (0.38) | ALDH1A1CYP1A2CYP3A4CYP2C9HPGD | |
| SCHEMBL7938413 | 0.76 | CYP1A2 (0.44) | ALDH1A1CYP1A2CYP3A4CYP2C9HPGD | |
| SCHEMBL7937482 | 0.75 | CYP1A2 (0.46) | ALDH1A1CYP1A2CYP3A4CYP2C9HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010008775-A1 | AMINOPYRIDOPYRAZINONE DERIVATIVES FOR TREATING NEURODEGENERATIVE DISEASES | LIGAND PHARMACEUTICALS INC. (US) | 2010-01-21 | — | — | WO | disclosed |