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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 6/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | APLNR | P35414 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | SAT1 | P21673 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | FUCA1 | P04066 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL28141572 | 0.89 | — | — | |
| SCHEMBL130642 | 0.89 | ESR2 (0.46) | ESR1ESR2CYP3A4CYP2C9APLNR | |
| SCHEMBL27912 | 0.89 | ESR2 (0.46) | ESR1ESR2CYP3A4CYP2C9APLNR | |
| SCHEMBL4610 | 0.89 | — | — | |
| SCHEMBL1316560 | 0.89 | ESR2 (0.46) | ESR1ESR2CYP3A4CYP2C9APLNR | |
| SCHEMBL297828 | 0.89 | ESR2 (0.46) | ESR1ESR2CYP3A4CYP2C9APLNR | |
| SCHEMBL2267415 | 0.89 | ESR2 (0.46) | ESR1ESR2CYP3A4CYP2C9APLNR | |
| Alcohol SCHEMBL3157273 | 0.87 | — | — | |
| SCHEMBL15473312 | 0.87 | ESR1 (0.38) | ALDH1A1ESR1ESR2CYP3A4CYP2C9 | |
| SCHEMBL11227203 | 0.87 | ESR1 (0.38) | ALDH1A1ESR1ESR2CYP3A4CYP2C9 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112552652-A | Degradable PETG material and application thereof | 银金达(上海)新材料有限公司 | 2021-03-26 | — | — | CN | claimed |
| CN-112538238-A | Antistatic breakdown PETG material and application thereof | 银金达(上海)新材料有限公司 | 2021-03-23 | — | — | CN | claimed |
| CN-112266586-A | High-toughness PETG material and application thereof | 银金达(上海)新材料有限公司 | 2021-01-26 | — | — | CN | claimed |
| EP-0294718-B1 | Flexible magnetic recording material with improved adhesion | HOECHST CELANESE CORP (US) | 1994-03-16 | — | — | EP | claimed |
| EP-0197195-B1 | POLYESTER-POLYURETHANE COMPOSITION AND USE THEREOF | International Business Machines Corporation (US) | 1989-05-24 | — | — | EP | claimed |
| EP-0294718-A2 | Flexible magnetic recording material with improved adhesion | HOECHST CELANESE CORPORATION (US) | 1988-12-14 | — | — | EP | claimed |
| CN-105229502-B | Phase retardation film, the circular polarizing disk and image display device for having used the phase retardation film | 柯尼卡美能达株式会社 | 2017-09-15 | — | — | CN | disclosed |