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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL5316416 | 0.92 | LMNA (0.57) | LMNAADRA2AMAPTALDH1A1ADRA2B | |
| SCHEMBL17046229 | 0.92 | LMNA (0.57) | LMNAADRA2AMAPTALDH1A1ADRA2B | |
| SCHEMBL20852333 | 0.92 | LMNA (0.61) | LMNAADRA2AMAPTALDH1A1ADRA2B | |
| SCHEMBL4916223 | 0.92 | LMNA (0.61) | LMNAADRA2AMAPTALDH1A1ADRA2B | |
| SCHEMBL7709 | 0.92 | — | — | |
| SCHEMBL7707049 | 0.90 | LMNA (0.59) | LMNAADRA2AMAPTALDH1A1ADRA2B | |
| Water SCHEMBL9462188 | 0.90 | LMNA (0.59) | LMNAADRA2AMAPTALDH1A1ADRA2B | |
| SCHEMBL9573532 | 0.90 | LMNA (0.59) | LMNAADRA2AMAPTALDH1A1ADRA2B | |
| Iodide SCHEMBL17710408 | 0.90 | LMNA (0.59) | LMNAADRA2AMAPTALDH1A1ADRA2B | |
| Ethane SCHEMBL29007244 | 0.90 | LMNA (0.59) | LMNAADRA2AMAPTALDH1A1ADRA2B |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103221381-B | The preparation method of (methyl) acrylate of N, N-substituted-amino alcohol | BASF SE (DE) | 2015-08-05 | — | — | CN | claimed |
| CN-103221381-A | Process for preparing (meth)acrylic esters of n,n-ubstituted amino alcohols | BASF SE | 2013-07-24 | — | — | CN | claimed |
| CN-104388089-B | A kind of preparation method of hydridization perovskite quanta point material | 深圳TCL新技术有限公司 | 2017-06-06 | — | — | CN | disclosed |
| CN-103221381-B | The preparation method of (methyl) acrylate of N, N-substituted-amino alcohol | BASF SE (DE) | 2015-08-05 | — | — | CN | disclosed |
| CN-103221381-A | Process for preparing (meth)acrylic esters of n,n-ubstituted amino alcohols | BASF SE | 2013-07-24 | — | — | CN | disclosed |
| EP-0411409-A1 | Tert.-butylesters of substituted 3-hydroxyproponoic acid | BASF Aktiengesellschaft (DE) | 1991-02-06 | — | — | EP | disclosed |
| US-4638053-A | Process for the preparation of chlorozincate salts of benzo thiazolium azo dyestuffs by alkylating with dialkylsulfate in aqueous medium in the presence of Zn-containing acid acceptor at pH≦7 | HOECHSTAKTIENGESELLSCHAFT (DE) | 1987-01-20 | — | — | US | disclosed |
| US-3991043-A | Quaternization of benzthiazole-azo compounds | TOMS RIVER CHEMICAL CORPORATION (US) | 1976-11-09 | — | — | US | disclosed |