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 | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 12/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PYGB | P11216 | 1/20 | 0.39 |
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 SCHEMBL28503992 | 1.00 | GBA1 (0.57) | GBA1MAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL27919573 | 0.98 | GBA1 (0.59) | GBA1MAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL28491427 | 0.98 | GBA1 (0.59) | GBA1MAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL26108670 | 0.98 | GBA1 (0.59) | GBA1MAPK1KDM4ELMNACYP2D6 | |
| Hexane SCHEMBL28784867 | 0.98 | GBA1 (0.59) | GBA1MAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL23787746 | 0.98 | GBA1 (0.59) | GBA1MAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL30731536 | 0.98 | GBA1 (0.59) | GBA1MAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL10786697 | 0.98 | GBA1 (0.59) | GBA1MAPK1KDM4ELMNACYP2D6 | |
| SCHEMBL29120516 | 0.98 | GBA1 (0.59) | GBA1MAPK1KDM4ELMNACYP2D6 | |
| Hydrochloric Acid SCHEMBL28434598 | 0.97 | GBA1 (0.60) | GBA1MAPK1KDM4ELMNACYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112142805-B | N-alkylglucosamine small-molecule alcohol gel and preparation method and application thereof | 江南大学 | 2022-03-25 | — | — | CN | disclosed |
| CN-112142805-A | N-alkylglucosamine small-molecule alcohol gel and preparation method and application thereof | 江南大学 | 2020-12-29 | — | — | CN | disclosed |