Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Alcohol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL1580146 | 0.92 | CYP2C19 (0.33) | CYP2C19ALDH1A1TSHR | |
| SCHEMBL287854 | 0.89 | — | — | |
| SCHEMBL2022523 | 0.84 | — | — | |
| SCHEMBL27533799 | 0.79 | SLC6A4 (0.35) | CYP2C19ALDH1A1TSHR | |
| SCHEMBL5049749 | 0.79 | SLC6A4 (0.35) | CYP2C19ALDH1A1TSHR | |
| SCHEMBL1988629 | 0.79 | SLC6A4 (0.35) | CYP2C19ALDH1A1TSHR | |
| SCHEMBL322047 | 0.79 | SLC6A4 (0.35) | CYP2C19ALDH1A1TSHR | |
| SCHEMBL373949 | 0.78 | — | — | |
| SCHEMBL595778 | 0.78 | CYP2C19 (0.37) | CYP2C19ALDH1A1TSHR | |
| SCHEMBL110368 | 0.77 | CYP4F2 (0.34) | CYP2C19TSHR |
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-1352948-A1 | Concentrated, stable, fabric softening composition | THE PROCTER & GAMBLE COMPANY (US) | 2003-10-15 | — | — | EP | disclosed |