Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | APEX1 | P27695 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | STAT6 | P42226 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28159135 | 0.84 | POLB (0.51) | CYP1A2CYP2C19CYP2D6CYP3A4MAPK1 | |
| SCHEMBL28159148 | 0.81 | POLB (0.54) | CYP1A2CYP2C19CYP2D6CYP3A4MAPK1 | |
| SCHEMBL29023733 | 0.78 | CYP1A2 (0.58) | CYP1A2CYP2C19CYP2D6CYP3A4MAPK1 | |
| SCHEMBL10403954 | 0.78 | CYP1A2 (0.58) | CYP1A2CYP2C19CYP2D6CYP3A4MAPK1 | |
| SCHEMBL10402125 | 0.78 | APEX1 (0.64) | CYP1A2CYP2C19CYP2D6CYP3A4MAPK1 | |
| SCHEMBL7327983 | 0.74 | DRD2 (0.56) | CYP1A2CYP2C19CYP2D6CYP3A4MAPK1 | |
| SCHEMBL3407208 | 0.74 | NPC1 (0.65) | CYP1A2CYP2C19CYP2D6CYP3A4MAPK1 | |
| SCHEMBL10989220 | 0.72 | CYP1A2 (0.67) | CYP1A2CYP2C19CYP2D6CYP3A4MAPK1 | |
| SCHEMBL13768047 | 0.72 | CYP1A2 (0.67) | CYP1A2CYP2C19CYP2D6CYP3A4MAPK1 | |
| SCHEMBL29278087 | 0.71 | CYP1A2 (0.65) | CYP1A2CYP2C19CYP2D6CYP3A4MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106986843-A | A kind of preparation method of α heterocycles thioether ketone compounds | 湖南理工学院 | 2017-07-28 | — | — | CN | disclosed |