Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.32 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.32 |
| ▸ | RARG | P13631 | 2/20 | 0.31 |
| ▸ | RXRA | P19793 | 2/20 | 0.31 |
| ▸ | PPARG | P37231 | 2/20 | 0.31 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.31 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.31 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | XBP1 | P17861 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL5994628 | 0.88 | CYP2C19 (0.33) | CYP2C19CYP1A2CYP3A4CYP2C9TSHR | |
| SCHEMBL29421158 | 0.81 | CYP1A2 (0.34) | CYP2C19CYP1A2CYP3A4CYP2C9TSHR | |
| SCHEMBL39337 | 0.81 | CYP1A2 (0.34) | CYP2C19CYP1A2CYP3A4CYP2C9TSHR | |
| SCHEMBL8913292 | 0.74 | CYP1A2 (0.31) | CYP2C19CYP1A2CYP3A4CYP2C9TSHR | |
| SCHEMBL27567436 | 0.74 | NR5A2 (0.37) | CYP2C19CYP1A2CYP3A4CYP2C9TSHR | |
| SCHEMBL8919537 | 0.71 | — | — | |
| SCHEMBL1859062 | 0.71 | CYP1A2 (0.33) | CYP2C19CYP1A2CYP3A4CYP2C9TSHR | |
| SCHEMBL30967276 | 0.69 | ALDH1A1 (0.36) | CYP2C19CYP1A2CYP3A4CYP2C9TSHR | |
| SCHEMBL9278616 | 0.69 | ALDH1A1 (0.36) | CYP2C19CYP1A2CYP3A4CYP2C9TSHR | |
| SCHEMBL2186175 | 0.69 | RXRA (0.33) | CYP2C19CYP1A2CYP3A4CYP2C9TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-20060051478-A1 | Antioxidant for fats,oils and food | CIBA SPECIALTY CHEMICALS CORP. | 2006-03-09 | — | — | US | disclosed |