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 | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | MIF | P14174 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 3/20 | 0.36 |
| ▸ | CES1 | P23141 | 3/20 | 0.36 |
| ▸ | PPARG | P37231 | 5/20 | 0.34 |
| ▸ | PPARD | Q03181 | 5/20 | 0.34 |
| ▸ | PPARA | Q07869 | 5/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.34 |
| ▸ | TLR2 | O60603 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | FABP4 | P15090 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Hexane SCHEMBL2866709 | 0.93 | NAAA (0.58) | NAAAMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL5571386 | 0.93 | NAAA (0.58) | NAAAMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL1493031 | 0.93 | NAAA (0.58) | NAAAMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL10870593 | 0.93 | NAAA (0.58) | NAAAMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL37419 | 0.93 | NAAA (0.58) | NAAAMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL15486455 | 0.93 | NAAA (0.58) | NAAAMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL5575642 | 0.93 | NAAA (0.58) | NAAAMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL10791564 | 0.93 | NAAA (0.58) | NAAAMEN1KMT2ATSHRALDH1A1 | |
| SCHEMBL527174 | 0.93 | NAAA (0.58) | NAAAMEN1KMT2ATSHRALDH1A1 | |
| Nonane SCHEMBL3071312 | 0.93 | NAAA (0.58) | NAAAMEN1KMT2ATSHRALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5633328-A | HEAT RESISTANT; PRESSURE SENSITIVE ADHESIVES | NIPPON SHOKUBAI CO., LTD. (JP) | 1997-05-27 | — | — | US | disclosed |
| US-5484841-A | Method for production of aqueous dispersion of long-chain alkyl graft polymer and aqueous release agent | NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) | 1996-01-16 | — | — | US | disclosed |
| EP-0409218-B1 | Method for production of aqueous dispersion of long-chain alkyl graft polymer and aqueous release agent | NIPPON CATALYTIC CHEM IND (JP) | 1995-01-25 | — | — | EP | disclosed |
| EP-0409218-A2 | Method for production of aqueous dispersion of long-chain alkyl graft polymer and aqueous release agent | NIPPON SHOKUBAI KAGAKU KOGYO CO. LTD. (JP) | 1991-01-23 | — | — | EP | disclosed |