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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL216127 | 0.95 | TSHR (0.36) | TSHRTHRBALDH1A1 | |
| Methacrylic Acid SCHEMBL28063227 | 0.90 | TSHR (0.33) | TSHRALDH1A1 | |
| SCHEMBL29019014 | 0.89 | ALDH1A1 (0.47) | TSHRALDH1A1 | |
| Acrylic Acid SCHEMBL28280460 | 0.86 | TSHR (0.31) | TSHR | |
| SCHEMBL28116628 | 0.85 | TSHR (0.30) | TSHR | |
| SCHEMBL31155812 | 0.85 | TSHR (0.30) | TSHR | |
| SCHEMBL9303668 | 0.83 | TSHR (0.37) | TSHRTHRBALDH1A1 | |
| SCHEMBL28678100 | 0.83 | HTT (0.37) | TSHR | |
| SCHEMBL28988590 | 0.82 | — | — | |
| SCHEMBL9303524 | 0.81 | ALDH1A1 (0.39) | TSHRTHRBALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105727763-B | A kind of preparation method of fluorine-containing polyamide composite nanofiltration membrane | 天津大学 | 2018-05-22 | — | — | CN | disclosed |