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 | 5/20 | 0.83 |
| ▸ | MAPT | P10636 | 6/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.54 |
| ▸ | THRB | P10828 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | MPI | P34949 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29358409 | 0.91 | ERN1 (1.00) | ERN1MAPTKDM4EL3MBTL1THRB | |
| SCHEMBL304032 | 0.91 | ERN1 (1.00) | ERN1MAPTKDM4EL3MBTL1THRB | |
| SCHEMBL28033846 | 0.89 | ERN1 (0.96) | ERN1MAPTKDM4EL3MBTL1THRB | |
| SCHEMBL11520332 | 0.89 | ERN1 (0.96) | ERN1MAPTKDM4EL3MBTL1THRB | |
| SCHEMBL11407376 | 0.89 | ERN1 (0.96) | ERN1MAPTKDM4EL3MBTL1THRB | |
| Hydrazine SCHEMBL28732767 | 0.87 | ERN1 (0.92) | ERN1MAPTKDM4EL3MBTL1THRB | |
| 1,6-Hexanediol SCHEMBL27875319 | 0.87 | ERN1 (0.77) | ERN1MAPTKDM4EL3MBTL1THRB | |
| Acetonitrile SCHEMBL28309194 | 0.85 | ERN1 (0.80) | ERN1MAPTKDM4EL3MBTL1THRB | |
| Phenol SCHEMBL2787265 | 0.84 | ERN1 (0.86) | ERN1MAPTKDM4EL3MBTL1THRB | |
| Orthocresol SCHEMBL2131451 | 0.83 | ERN1 (0.77) | ERN1MAPTKDM4EL3MBTL1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105802608-A | Preparation method of fluorescent probe and application of fluorescent probe in aluminum ion detection | 温州医科大学 | 2016-07-27 | — | — | CN | claimed |
| CN-105802608-B | A kind of preparation method of fluorescence probe and its application in aluminium ion detection | 温州医科大学 | 2018-10-23 | — | — | CN | disclosed |
| CN-105802608-A | Preparation method of fluorescent probe and application of fluorescent probe in aluminum ion detection | 温州医科大学 | 2016-07-27 | — | — | CN | disclosed |