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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.72 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.72 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| Alcohol SCHEMBL4624950 | 1.00 | — | — | |
| Alcohol SCHEMBL7923605 | 0.97 | ALDH1A1 (0.68) | ALDH1A1TDP1TSHRSMN1; SMN2 | |
| Propane SCHEMBL23011949 | 0.88 | — | — | |
| Methyl Alcohol SCHEMBL28760693 | 0.88 | — | — | |
| Propane SCHEMBL23011948 | 0.88 | — | — | |
| Butane SCHEMBL28292811 | 0.86 | — | — | |
| Ethylene Glycol SCHEMBL8467093 | 0.86 | — | — | |
| Hydrogen Peroxide SCHEMBL28159702 | 0.85 | — | — | |
| SCHEMBL17976 | 0.85 | — | — | |
| SCHEMBL31018802 | 0.85 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5015754-A | Cationic polyethers for fixing reative and direct dyes used for dyeing and printing cellulose textiles; washfastness | BASF AKTIENGESELLSCHAFT (DE) | 1991-05-14 | — | — | US | disclosed |