Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.52 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.52 |
| ▸ | CCR5 | P51681 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | C3AR1 | Q16581 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8775877 | 1.00 | CYP3A4 (0.52) | CYP3A4CYP2C19ALDH1A1CYP2D6CYP2C9 | |
| SCHEMBL8775931 | 0.89 | CYP3A4 (0.55) | CYP3A4CYP2C19ALDH1A1CYP2D6CYP2C9 | |
| SCHEMBL8775854 | 0.88 | TBXAS1 (0.47) | CYP3A4CYP2C19ALDH1A1CYP2D6CYP2C9 | |
| SCHEMBL8775855 | 0.86 | TBXAS1 (0.54) | CYP3A4CYP2C19ALDH1A1CYP2D6CYP2C9 | |
| SCHEMBL8776121 | 0.84 | ALDH1A1 (0.51) | CYP3A4CYP2C19ALDH1A1CYP2D6CYP2C9 | |
| SCHEMBL8775759 | 0.80 | TBXAS1 (0.62) | CYP2C19CYP2C9TBXAS1SMN1; SMN2LMNA | |
| SCHEMBL8775890 | 0.80 | TBXAS1 (0.62) | CYP2C19CYP2C9TBXAS1SMN1; SMN2LMNA | |
| SCHEMBL8775859 | 0.79 | TBXAS1 (0.60) | CYP2C19CYP2C9TBXAS1SMN1; SMN2LMNA | |
| SCHEMBL8776050 | 0.76 | ALDH1A1 (0.46) | CYP3A4CYP2C19ALDH1A1CYP2D6CYP2C9 | |
| SCHEMBL8775881 | 0.73 | TBXAS1 (0.54) | CYP2C19ALDH1A1CYP2C9TBXAS1LMNA |
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-0807626-A1 | N-HYDROXYUREA DERIVATIVES | Nikken Chemicals Company, Limited (JP) | 1997-11-19 | — | — | EP | disclosed |