Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12197685 | 0.85 | ALDH1A1 (0.33) | ALDH1A1CYP2C19 | |
| SCHEMBL12197701 | 0.77 | FDPS (0.30) | — | |
| SCHEMBL19390866 | 0.75 | — | — | |
| SCHEMBL600697 | 0.73 | ALDH1A1 (0.39) | ALDH1A1CYP2C19TSHR | |
| SCHEMBL10448455 | 0.73 | ALDH1A1 (0.39) | ALDH1A1CYP2C19TSHR | |
| SCHEMBL10306782 | 0.72 | TSHR (0.38) | ALDH1A1CYP2C19TSHR | |
| SCHEMBL10937538 | 0.72 | TSHR (0.38) | ALDH1A1CYP2C19TSHR | |
| SCHEMBL8648090 | 0.72 | — | — | |
| SCHEMBL42225 | 0.71 | ALDH1A1 (0.37) | ALDH1A1CYP2C19TSHR | |
| SCHEMBL10024523 | 0.71 | ALDH1A1 (0.37) | ALDH1A1CYP2C19TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012041918-A2 | PROCESS FOR THE MANUFACTURE OF HYDROGEN PEROXIDE | SOLVAY SA (BE) | 2012-04-05 | — | — | WO | disclosed |