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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 7/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | TYR | P14679 | 2/20 | 0.49 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.49 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.38 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1019524 | 0.90 | ERN1 (0.69) | ERN1TDP1TYRTRIM24TRIM33 | |
| SCHEMBL11407699 | 0.88 | ERN1 (0.67) | ERN1TDP1TYRTRIM24TRIM33 | |
| Alcohol SCHEMBL28460788 | 0.85 | ERN1 (0.81) | ERN1TDP1CYP3A4ALDH1A1TSHR | |
| Formaldehyde SCHEMBL28559904 | 0.85 | ERN1 (0.62) | ERN1TDP1TYRTRIM24TRIM33 | |
| Formamide SCHEMBL28559903 | 0.85 | ERN1 (0.62) | ERN1TDP1TYRTRIM24TRIM33 | |
| Salicyladehyde SCHEMBL7095680 | 0.81 | TRIM24 (0.67) | ERN1TDP1TYRTRIM24TRIM33 | |
| Alcohol SCHEMBL28467997 | 0.78 | ERN1 (0.58) | ERN1TYRTRIM24TRIM33CASP1 | |
| Alcohol SCHEMBL28646336 | 0.78 | ERN1 (0.45) | ERN1TYRTRIM24TRIM33 | |
| Alcohol SCHEMBL28369215 | 0.76 | ERN1 (0.52) | ERN1TDP1CYP3A4ALDH1A1TSHR | |
| SCHEMBL5736354 | 0.76 | ALOX5 (0.59) | ERN1TDP1TYRTRIM24TRIM33 |
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-108586623-B | Cellulose-based Schiff base catalyst and preparation method and application thereof | 昆明理工大学 | 2020-08-25 | — | — | CN | disclosed |