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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | FBP1 | P09467 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL3635708 | 0.94 | ALDH1A1 (0.43) | ALDH1A1TSHRLMNATDP1MEN1 | |
| SCHEMBL351370 | 0.93 | ALDH1A1 (0.55) | ALDH1A1TSHRLMNATDP1MEN1 | |
| SCHEMBL8824100 | 0.93 | ALDH1A1 (0.55) | ALDH1A1TSHRLMNATDP1MEN1 | |
| SCHEMBL629143 | 0.81 | ALDH1A1 (0.52) | ALDH1A1TSHRLMNATDP1MEN1 | |
| SCHEMBL5981423 | 0.76 | LMNA (0.55) | ALDH1A1TSHRLMNATDP1MEN1 | |
| SCHEMBL9155729 | 0.73 | FBP1 (0.41) | ALDH1A1TSHRMEN1KMT2AAKR1C3 | |
| Benzaldehyde SCHEMBL9780149 | 0.72 | ALDH1A1 (0.70) | ALDH1A1TSHRLMNATDP1MEN1 | |
| SCHEMBL9811808 | 0.71 | ALDH1A1 (0.47) | ALDH1A1TSHRLMNATDP1MEN1 | |
| SCHEMBL7802781 | 0.71 | LMNA (0.48) | ALDH1A1TSHRLMNATDP1KMT2A | |
| SCHEMBL3337166 | 0.69 | LMNA (0.66) | ALDH1A1TSHRLMNATDP1MEN1 |
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-109239063-A | A kind of rapid detection method of melatonin in health products | 杭州天迈生物科技有限公司 | 2019-01-18 | — | — | CN | disclosed |
| CN-103969454-B | Melatonin method for quick and detection thereof block and preparation method | 深圳市药品检验所 | 2016-06-08 | — | — | CN | disclosed |