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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | SQLE | Q14534 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.31 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.31 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1065703 | 0.97 | — | — | |
| SCHEMBL1065705 | 0.97 | — | — | |
| SCHEMBL3243979 | 0.83 | — | — | |
| SCHEMBL6709749 | 0.81 | — | — | |
| SCHEMBL8573777 | 0.79 | SQLE (0.43) | BACE1SQLEGRIK1GRIK2 | |
| SCHEMBL8573776 | 0.79 | SQLE (0.43) | BACE1SQLEGRIK1GRIK2 | |
| SCHEMBL11801673 | 0.78 | EP300 (0.47) | ALDH1A1TSHR | |
| SCHEMBL11801676 | 0.78 | EP300 (0.47) | ALDH1A1TSHR | |
| SCHEMBL27567754 | 0.77 | SQLE (0.42) | BACE1SQLEGRIK1GRIK2 | |
| SCHEMBL28052939 | 0.76 | BACE1 (0.47) | BACE1ALDH1A1TSHR |
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-2009012415-A1 | INSECT REPELLENT COMPOSITION | TYRATECH, INC. (US) | 2009-01-22 | — | — | WO | disclosed |