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 | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | STAT3 | P40763 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.40 |
| ▸ | VDR | P11473 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL169846 | 0.93 | C5AR1 (0.44) | NPSR1STAT3C5AR1VDRGAA | |
| SCHEMBL28664754 | 0.92 | C5AR1 (0.43) | NPSR1STAT3C5AR1VDRGAA | |
| Ammonia Solution, Strong SCHEMBL12478377 | 0.92 | C5AR1 (0.43) | NPSR1STAT3C5AR1VDRGAA | |
| Alcohol SCHEMBL11280156 | 0.89 | CNR2 (0.43) | STAT3LMNAMAPK1C5AR1VDR | |
| Ether SCHEMBL12487654 | 0.89 | C5AR1 (0.39) | NPSR1STAT3C5AR1GAAKMT2A | |
| Trimethylammonium SCHEMBL4908728 | 0.89 | C5AR1 (0.44) | NPSR1STAT3LMNAC5AR1VDR | |
| SCHEMBL14780436 | 0.87 | C5AR1 (0.40) | NPSR1STAT3LMNAC5AR1VDR | |
| SCHEMBL27597410 | 0.84 | CA1 (0.48) | LMNAMAPK1ALDH1A1CA12CA1 | |
| Benzoic Acid SCHEMBL4778409 | 0.83 | STAT3 (0.54) | NPSR1STAT3LMNAC5AR1GAA | |
| Alcohol SCHEMBL27355866 | 0.83 | PARL (0.39) | MAPK1KMT2AMEN1ALDH1A1CA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-4309351-A | INTERMEDIATES FOR PROSTAGLANDIN-LIKE COMPOUNDS | THE UNIVERSITY OF CHICAGO (US) | 1982-01-05 | — | — | US | disclosed |