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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.77 |
| ▸ | ENPP2 | Q13822 | 8/20 | 0.75 |
| ▸ | LPAR3 | Q9UBY5 | 7/20 | 0.75 |
| ▸ | LPAR1 | Q92633 | 6/20 | 0.75 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.75 |
| ▸ | PRKCA | P17252 | 2/20 | 0.67 |
| ▸ | PRKCE | Q02156 | 2/20 | 0.67 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.67 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.67 |
| ▸ | MAPT | P10636 | 1/20 | 0.67 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.67 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.58 |
| ▸ | LPAR6 | P43657 | 1/20 | 0.58 |
| ▸ | LPAR4 | Q99677 | 1/20 | 0.58 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL22798410 | 0.99 | S1PR1 (0.79) | S1PR1ENPP2LPAR3LPAR1SMN1; SMN2 | |
| SCHEMBL16040993 | 0.99 | S1PR1 (0.79) | S1PR1ENPP2LPAR3LPAR1SMN1; SMN2 | |
| SCHEMBL27892952 | 0.99 | S1PR1 (0.79) | S1PR1ENPP2LPAR3LPAR1SMN1; SMN2 | |
| SCHEMBL18932079 | 0.99 | S1PR1 (0.79) | S1PR1ENPP2LPAR3LPAR1SMN1; SMN2 | |
| SCHEMBL22798379 | 0.99 | S1PR1 (0.79) | S1PR1ENPP2LPAR3LPAR1SMN1; SMN2 | |
| SCHEMBL22798411 | 0.99 | S1PR1 (0.79) | S1PR1ENPP2LPAR3LPAR1SMN1; SMN2 | |
| SCHEMBL22798172 | 0.99 | S1PR1 (0.79) | S1PR1ENPP2LPAR3LPAR1SMN1; SMN2 | |
| SCHEMBL22798380 | 0.99 | S1PR1 (0.79) | S1PR1ENPP2LPAR3LPAR1SMN1; SMN2 | |
| Monoethanolamine SCHEMBL28004764 | 0.92 | S1PR1 (0.71) | S1PR1ENPP2LPAR3LPAR1SMN1; SMN2 | |
| SCHEMBL22798371 | 0.91 | S1PR1 (0.93) | S1PR1ENPP2LPAR3LPAR1SMN1; SMN2 |
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-103384515-B | Lipids suitable for liposomal delivery of protein-coding RNA | 诺华有限公司 | 2017-02-15 | — | — | CN | disclosed |