Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3368788 | 0.81 | TAAR1 (0.64) | TAAR1CYP3A4ALDH1A1CYP2C19KMT2A | |
| SCHEMBL21504867 | 0.79 | MAPT (0.46) | TAAR1ALDH1A1MEN1KMT2AMAPK1 | |
| SCHEMBL10179398 | 0.79 | MEN1 (0.48) | ALDH1A1MEN1KMT2A | |
| SCHEMBL2850041 | 0.79 | HTT (0.38) | CYP2D6CYP3A4ALDH1A1HSD17B10MEN1 | |
| SCHEMBL8122229 | 0.79 | — | — | |
| SCHEMBL25865911 | 0.79 | SHBG (0.53) | CYP3A4ALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL872854 | 0.79 | CYP2C19 (0.46) | RIPK1CYP2D6ALDH1A1CYP2C19HSD17B10 | |
| SCHEMBL19342877 | 0.79 | CYP2D6 (0.42) | TAAR1RIPK1CYP2D6CYP3A4ALDH1A1 | |
| SCHEMBL21462898 | 0.78 | RIPK1 (0.40) | TAAR1RIPK1CYP2D6CYP3A4ALDH1A1 | |
| SCHEMBL5747744 | 0.78 | KIF11 (0.47) | TAAR1RIPK1CYP2C19KMT2AHIF1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0985649-B1 | Method for producing an aromatic compound having an alkyl group with at least three carbon atoms | TORAY INDUSTRIES (JP) | 2004-11-24 | — | — | EP | disclosed |
| US-6462248-B1 | THROUGH CONVERSION, ISOMERIZATION AND/OR ADSORPTIVE SEPARATION OF AROMATIC COMPOUNDS | TORAY INDUSTRIES, INC. (JP) | 2002-10-08 | — | — | US | disclosed |
| EP-0985649-A2 | Method for producing an aromatic compound having an alkyl group with at least three carbon atoms | TORAY INDUSTRIES, INC. (JP) | 2000-03-15 | — | — | EP | disclosed |