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 | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 7/20 | 0.56 |
| ▸ | MEN1 | O00255 | 6/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | THRB | P10828 | 3/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.56 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.56 |
| ▸ | USP2 | O75604 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | RECQL | P46063 | 2/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | APEX1 | P27695 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | GFER | P55789 | 1/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | CDC25B | P30305 | 1/20 | 0.53 |
| ▸ | CASP6 | P55212 | 1/20 | 0.53 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27577526 | 0.91 | KMT2A (0.67) | KMT2AMEN1MAPTTHRBTDP1 | |
| SCHEMBL30120212 | 0.89 | KMT2A (0.65) | KMT2AMEN1MAPTTHRBTDP1 | |
| SCHEMBL258366 | 0.89 | KMT2A (0.65) | KMT2AMEN1MAPTTHRBTDP1 | |
| SCHEMBL8220007 | 0.82 | KDM4E (0.55) | KMT2AMEN1MAPTTHRBTDP1 | |
| Gentisic Acid SCHEMBL27807244 | 0.79 | CA1 (0.80) | KMT2AMEN1MAPTTHRBTDP1 | |
| SCHEMBL30267852 | 0.78 | HSP90AB1 (0.61) | KMT2AMEN1MAPTTHRBTDP1 | |
| SCHEMBL459040 | 0.78 | HSP90AB1 (0.61) | KMT2AMEN1MAPTTHRBTDP1 | |
| Hydrochloric Acid SCHEMBL28066278 | 0.76 | CA12 (0.68) | KMT2AMEN1MAPTTHRBTDP1 | |
| SCHEMBL7139595 | 0.75 | HSD17B3 (0.52) | KMT2AMEN1MAPTTHRBTDP1 | |
| Hydrochloric Acid SCHEMBL9797011 | 0.75 | ALDH1A1 (0.59) | KMT2AMEN1MAPTTHRBTDP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105663107-A | Compound amino acid capsule | 李兴惠 | 2016-06-15 | — | — | CN | disclosed |