Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 5/20 | 0.38 |
| ▸ | MTOR | P42345 | 5/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 11/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.33 |
| ▸ | CASP1 | P29466 | 4/20 | 0.33 |
| ▸ | CASP7 | P55210 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | GLA | P06280 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7937482 | 0.81 | CYP1A2 (0.46) | AKT1MTORCYP1A2ALDH1A1HPGD | |
| SCHEMBL7937497 | 0.80 | AKT1 (0.41) | AKT1MTORCYP1A2ALDH1A1HPGD | |
| SCHEMBL7938046 | 0.80 | AKT1 (0.37) | AKT1MTORCYP1A2ALDH1A1HPGD | |
| SCHEMBL7946948 | 0.79 | CYP1A2 (0.40) | AKT1MTORCYP1A2ALDH1A1HPGD | |
| SCHEMBL7943737 | 0.79 | CYP1A2 (0.57) | AKT1MTORCYP1A2ALDH1A1HPGD | |
| SCHEMBL7945874 | 0.78 | ADORA2A (0.43) | AKT1MTORALDH1A1TSHRADORA2A | |
| SCHEMBL7937742 | 0.78 | CYP1A2 (0.44) | CYP1A2ALDH1A1HPGDTSHRALOX15 | |
| SCHEMBL7938293 | 0.77 | CYP1A2 (0.48) | AKT1MTORCYP1A2ALDH1A1HPGD | |
| SCHEMBL7945511 | 0.77 | AKT1 (0.36) | AKT1MTORCYP1A2ALDH1A1HPGD | |
| SCHEMBL7938413 | 0.76 | CYP1A2 (0.44) | AKT1MTORCYP1A2ALDH1A1HPGD |
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 |