Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.38 |
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 | 0.88 | CYP3A4 (0.52) | TBXAS1ALDH1A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8775935 | 0.88 | CYP3A4 (0.52) | TBXAS1ALDH1A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8776050 | 0.84 | ALDH1A1 (0.46) | TBXAS1ALDH1A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8775855 | 0.78 | TBXAS1 (0.54) | TBXAS1ALDH1A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8775931 | 0.77 | CYP3A4 (0.55) | ALDH1A1CYP3A4CYP2D6CYP2C9TSHR | |
| SCHEMBL8775759 | 0.76 | TBXAS1 (0.62) | TBXAS1CYP2C9CYP2C19LMNAHTT | |
| SCHEMBL8775890 | 0.76 | TBXAS1 (0.62) | TBXAS1CYP2C9CYP2C19LMNAHTT | |
| SCHEMBL8776121 | 0.76 | ALDH1A1 (0.51) | TBXAS1ALDH1A1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8775859 | 0.74 | TBXAS1 (0.60) | TBXAS1CYP2C9CYP2C19LMNAHTT | |
| SCHEMBL8775932 | 0.70 | TBXAS1 (0.53) | TBXAS1CYP2C9CYP2C19OPRM1OPRD1 |
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 |