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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 1/20 | 0.48 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.48 |
| ▸ | DNPEP | Q9ULA0 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CTSK | P43235 | 5/20 | 0.47 |
| ▸ | CTSB | P07858 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CTSS | P25774 | 2/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.44 |
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 SCHEMBL7365467 | 0.95 | ALDH1A1 (0.51) | ANPEPRNPEPDNPEPALDH1A1CTSK | |
| Hydrochloric Acid SCHEMBL9697973 | 0.95 | ALDH1A1 (0.51) | ANPEPRNPEPDNPEPALDH1A1CTSK | |
| Hydrochloric Acid SCHEMBL1810902 | 0.95 | ALDH1A1 (0.51) | ANPEPRNPEPDNPEPALDH1A1CTSK | |
| SCHEMBL355730 | 0.94 | ALDH1A1 (0.53) | ANPEPRNPEPDNPEPALDH1A1CTSK | |
| SCHEMBL353695 | 0.94 | ALDH1A1 (0.53) | ANPEPRNPEPDNPEPALDH1A1CTSK | |
| SCHEMBL728728 | 0.94 | ALDH1A1 (0.53) | ANPEPRNPEPDNPEPALDH1A1CTSK | |
| Oxalic Acid SCHEMBL4393417 | 0.90 | ANPEP (0.49) | ANPEPRNPEPDNPEPALDH1A1CTSK | |
| Oxalic Acid SCHEMBL4393420 | 0.90 | ANPEP (0.49) | ANPEPRNPEPDNPEPALDH1A1CTSK | |
| Toluene SCHEMBL27746059 | 0.88 | ANPEP (0.48) | ANPEPRNPEPDNPEPALDH1A1CTSK | |
| Trifluoroacetic Acid SCHEMBL27697116 | 0.86 | ANPEP (0.49) | ANPEPRNPEPDNPEPALDH1A1CTSK |
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-109847455-A | A kind of composite material, preparation method and application for filtering fine particulates | 四川大学 | 2019-06-07 | — | — | CN | disclosed |