Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.37 |
| ▸ | CASP1 | P29466 | 6/20 | 0.37 |
| ▸ | CASP7 | P55210 | 6/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | USP2 | O75604 | 3/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | GLA | P06280 | 2/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | KDM6B | O15054 | 5/20 | 0.35 |
| ▸ | GFER | P55789 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7938346 | 0.84 | ALDH1A1 (0.38) | ALDH1A1CYP1A2CYP2C9CASP1CASP7 | |
| SCHEMBL3227758 | 0.82 | CYP1A2 (0.41) | ALDH1A1CYP1A2CYP2C9CASP1CASP7 | |
| SCHEMBL7938054 | 0.79 | AKT1 (0.41) | ALDH1A1CYP1A2CYP2C9CASP1CASP7 | |
| SCHEMBL3227759 | 0.77 | ALDH1A1 (0.39) | ALDH1A1CYP1A2CYP2C9CASP1CASP7 | |
| SCHEMBL7944716 | 0.77 | CYP1A2 (0.39) | ALDH1A1CYP1A2CYP2C9CASP1CASP7 | |
| SCHEMBL7938052 | 0.74 | CCND1 (0.38) | ALDH1A1CYP1A2CYP2C9CASP1CASP7 | |
| SCHEMBL7946078 | 0.74 | ADORA1 (0.36) | ALDH1A1CYP1A2CYP2C9CASP1CASP7 | |
| SCHEMBL7947006 | 0.72 | ALDH1A1 (0.34) | ALDH1A1CYP1A2CYP2C9CASP1CASP7 | |
| SCHEMBL7944790 | 0.72 | ADORA2A (0.37) | ALDH1A1CYP1A2HSD17B10ALOX15MAPT | |
| SCHEMBL7944000 | 0.71 | ALDH1A1 (0.33) | ALDH1A1CYP1A2CYP2C9CASP1CASP7 |
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 |