Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CCR9 | P51686 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL9169779 | 0.82 | NR1I2 (0.35) | CYP2D6CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL9175207 | 0.81 | CYP1A2 (0.38) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL9169927 | 0.81 | NR1I2 (0.35) | NR1I2ALOX15ALDH1A1HPGDHSD17B10 | |
| SCHEMBL9174345 | 0.78 | CYP1A2 (0.32) | CYP3A4CYP2C9CYP2C19CYP1A2TSHR | |
| SCHEMBL9169775 | 0.72 | NR1I2 (0.33) | NR1I2ALOX15ALDH1A1HPGDHSD17B10 | |
| SCHEMBL5071888 | 0.71 | ALDH1A1 (0.52) | CYP2D6CYP3A4CYP2C9CYP1A2TSHR | |
| SCHEMBL29438049 | 0.69 | ALDH1A1 (0.48) | CYP2D6KCNH2CYP2C19CYP1A2TSHR | |
| SCHEMBL29447635 | 0.69 | ALDH1A1 (0.48) | CYP2D6KCNH2CYP2C19CYP1A2TSHR | |
| SCHEMBL29438045 | 0.69 | ALDH1A1 (0.48) | CYP2D6KCNH2CYP2C19CYP1A2TSHR | |
| SCHEMBL983124 | 0.69 | ALDH1A1 (0.48) | CYP2D6KCNH2CYP2C19CYP1A2TSHR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0503564-B1 | Method for producing an aldehyde | MITSUBISHI CHEM CORP (JP) | 1995-06-14 | — | — | EP | disclosed |
| US-5306839-A | Ligands for hydroformylation catalysts | MITSUBISHI KASEI CORPORATION (JP) | 1994-04-26 | — | — | US | disclosed |
| US-5227532-A | Hydroformylation of olefin, rhodium catalyst, phosphite promoter | MITSUBISHI KASEI CORPORATION (JP) | 1993-07-13 | — | — | US | disclosed |
| EP-0503564-A2 | Method for producing an aldehyde | Mitsubishi Chemical Corporation (JP) | 1992-09-16 | — | — | EP | disclosed |