Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL11231048 | 0.63 | PEPD (0.31) | ALDH1A1 | |
| SCHEMBL11487102 | 0.62 | ALDH1A1 (0.31) | ALDH1A1TP53TYRTSHRTAS2R38 | |
| SCHEMBL28033967 | 0.61 | ALDH1A1 (0.34) | ALDH1A1CYP3A4CYP2D6CYP2C9HPGD | |
| SCHEMBL725810 | 0.55 | ALDH1A1 (0.75) | ALDH1A1CYP3A4CYP2D6CYP2C9HPGD | |
| SCHEMBL3789897 | 0.54 | — | — | |
| SCHEMBL1881297 | 0.52 | CYP1A2 (0.64) | ALDH1A1CYP3A4HPGDTP53TYR | |
| SCHEMBL220272 | 0.52 | ALDH1A1 (0.48) | ALDH1A1CYP3A4CYP2D6CYP2C9HPGD | |
| SCHEMBL219165 | 0.52 | ALDH1A1 (0.48) | ALDH1A1CYP3A4CYP2D6CYP2C9HPGD | |
| SCHEMBL1748177 | 0.52 | ALDH1A1 (0.48) | ALDH1A1CYP3A4CYP2D6CYP2C9HPGD | |
| SCHEMBL7593748 | 0.52 | L3MBTL1 (0.71) | ALDH1A1CYP3A4CYP2D6CYP2C9HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0125322-A1 | Process for the use of ergotropic agent combinations in the breeding and the fattening of useful animals | VEB Berlin-Chemie (DD) | 1984-11-21 | — | — | EP | disclosed |