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 | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.78 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | RORC | P51449 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29360183 | 0.88 | HSD17B10 (1.00) | HSD17B10KMT2AMAPTALDH1A1LMNA | |
| SCHEMBL85918 | 0.88 | HSD17B10 (1.00) | HSD17B10KMT2AMAPTALDH1A1LMNA | |
| Dinitrochlorobenzene SCHEMBL28015617 | 0.86 | HSD17B10 (0.56) | HSD17B10KMT2AALDH1A1VCAM1TDP1 | |
| Alcohol SCHEMBL28117794 | 0.84 | HSD17B10 (0.55) | HSD17B10KMT2AMAPTALDH1A1NPSR1 | |
| Ethylene SCHEMBL27630503 | 0.84 | HSD17B10 (0.91) | HSD17B10KMT2AMAPTALDH1A1LMNA | |
| Formic Acid SCHEMBL28068476 | 0.83 | HSD17B10 (0.81) | HSD17B10KMT2AMAPTALDH1A1LMNA | |
| Alcohol SCHEMBL28329576 | 0.80 | TSHR (0.61) | HSD17B10MAPTALDH1A1LMNATDP1 | |
| SCHEMBL7786691 | 0.79 | HSD17B10 (0.62) | HSD17B10KMT2AMAPTALDH1A1NPSR1 | |
| SCHEMBL13241715 | 0.79 | HSD17B10 (0.62) | HSD17B10KMT2AALDH1A1NPSR1LMNA | |
| Phenol SCHEMBL28068365 | 0.79 | HSD17B10 (0.72) | HSD17B10KMT2AMAPTALDH1A1LMNA |
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-106748753-B | The method of ethyl alcohol ethyl acetate coproduction arylamine | 江苏扬农化工集团有限公司 | 2019-04-12 | — | — | CN | disclosed |
| CN-106748753-A | The method of ethanol ethyl acetate coproduction arylamine | 江苏扬农化工集团有限公司 | 2017-05-31 | — | — | CN | disclosed |