Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10900222 | 0.87 | CYP1A2 (0.59) | CYP1A2CYP2A6ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL20631333 | 0.81 | CYP1A2 (0.50) | CYP1A2CYP2A6ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL14948472 | 0.81 | CYP2D6 (0.42) | CYP1A2ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL14948324 | 0.80 | CYP1A2 (0.42) | CYP1A2CYP2A6ALDH1A1GAACYP2D6 | |
| SCHEMBL31532953 | 0.75 | CYP1A2 (0.59) | CYP1A2CYP2A6ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL2141182 | 0.74 | GABRA1 (0.38) | CYP1A2CYP2A6ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL10053554 | 0.71 | CYP1A2 (0.65) | CYP1A2CYP2A6ALDH1A1CYP3A4 | |
| SCHEMBL13367583 | 0.71 | CYP1A2 (0.52) | CYP1A2CYP2A6ALDH1A1GAAAHR | |
| SCHEMBL12744236 | 0.69 | CYP2A6 (0.54) | CYP1A2CYP2A6ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL469267 | 0.69 | CYP1A2 (0.62) | CYP1A2CYP2A6ALDH1A1GAACYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-9184388-B2 | Layered structure, electronic device using same, aromatic compound, and method for manufacturing said compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2015-11-10 | — | — | US | disclosed |
| US-20130119369-A1 | LAYERED STRUCTURE, ELECTRONIC DEVICE USING SAME, AROMATIC COMPOUND, AND METHOD FOR MANUFACTURING SAID COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-05-16 | — | — | US | disclosed |