Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMD14 | O00487 | 2/20 | 0.30 |
| ▸ | PLA2G1B | P04054 | 2/20 | 0.30 |
| ▸ | MMP2 | P08253 | 2/20 | 0.30 |
| ▸ | ATG4B | Q9Y4P1 | 2/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | RAD52 | P43351 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ACACB | O00763 | 1/20 | 0.30 |
| ▸ | ACACA | Q13085 | 1/20 | 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 | |
|---|---|---|---|---|
| 1,6-Hexanediol SCHEMBL8722075 | 0.89 | PSMD14 (0.34) | PSMD14PLA2G1BMMP2ATG4BHSP90AA1 | |
| 1,6-Hexanediol SCHEMBL8720478 | 0.84 | PSMD14 (0.31) | PSMD14PLA2G1BMMP2ATG4BHSP90AA1 | |
| SCHEMBL2430421 | 0.78 | — | — | |
| SCHEMBL12011204 | 0.78 | — | — | |
| SCHEMBL36865 | 0.78 | — | — | |
| SCHEMBL13894349 | 0.78 | — | — | |
| 1,4-Butanediol SCHEMBL27601018 | 0.76 | SMN1; SMN2 (0.43) | PSMD14PLA2G1BMMP2ATG4BHSP90AA1 | |
| SCHEMBL8719041 | 0.75 | ACACB (0.30) | ACACBACACA | |
| SCHEMBL5907177 | 0.74 | SMN1; SMN2 (0.48) | ALDH1A1 | |
| SCHEMBL8896558 | 0.72 | ACACB (0.35) | ACACBACACA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0888424-A1 | FABRIC SOFTENING COMPOUND/COMPOSITION | THE PROCTER & GAMBLE COMPANY (US) | 1999-01-07 | — | — | EP | disclosed |
| WO-1997034972-A1 | FABRIC SOFTENING COMPOUND/COMPOSITION | THE PROCTER & GAMBLE COMPANY (US) | 1997-09-25 | — | — | WO | disclosed |