Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | UGT2B7 | P16662 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27642285 | 0.81 | GAA (0.36) | GAAALDH1A1TDP1 | |
| SCHEMBL8585012 | 0.74 | GAA (0.35) | GAAALDH1A1 | |
| SCHEMBL3869483 | 0.71 | GAA (0.33) | GAA | |
| SCHEMBL6444791 | 0.68 | ALDH1A1 (0.34) | GAAALDH1A1 | |
| SCHEMBL12265118 | 0.68 | ALDH1A1 (0.34) | GAAALDH1A1 | |
| SCHEMBL7247619 | 0.67 | HSD17B10 (0.35) | TRPA1 | |
| SCHEMBL844660 | 0.66 | — | — | |
| SCHEMBL12536749 | 0.65 | — | — | |
| SCHEMBL4988233 | 0.65 | — | — | |
| SCHEMBL28105554 | 0.65 | GAA (0.31) | GAA |
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-2006074979-A1 | USE OF 2,2-DIMETHYL-3-CYCLOHEXYL-1-PROPANOL AS A PERFUME | SYMRISE GMBH & CO. KG (DE) | 2006-07-20 | — | — | WO | disclosed |