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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 7/20 | 0.72 |
| ▸ | FAAH | O00519 | 2/20 | 0.60 |
| ▸ | MGLL | Q99685 | 2/20 | 0.60 |
| ▸ | KAT2A | Q92830 | 2/20 | 0.55 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.55 |
| ▸ | G6PD | P11413 | 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 | |
|---|---|---|---|---|
| SCHEMBL2963555 | 0.95 | CASP3 (0.68) | CASP3FAAHMGLLKAT2AKAT2B | |
| SCHEMBL29678965 | 0.84 | CASP3 (1.00) | CASP3FAAHMGLLKAT2AKAT2B | |
| SCHEMBL3143600 | 0.84 | CASP3 (1.00) | CASP3FAAHMGLLKAT2AKAT2B | |
| SCHEMBL8356552 | 0.81 | CASP3 (0.66) | CASP3FAAHMGLLKAT2AKAT2B | |
| SCHEMBL358740 | 0.81 | FAAH (0.77) | CASP3FAAHMGLLKAT2AKAT2B | |
| SCHEMBL11278746 | 0.80 | CASP3 (0.74) | CASP3FAAHMGLLKAT2AKAT2B | |
| SCHEMBL17948304 | 0.80 | CASP3 (0.72) | CASP3FAAHMGLLKAT2AKAT2B | |
| SCHEMBL19240713 | 0.79 | CASP3 (0.66) | CASP3FAAHMGLLKAT2AKAT2B | |
| SCHEMBL16601156 | 0.78 | FAAH (0.88) | CASP3FAAHMGLLKAT2AKAT2B | |
| SCHEMBL203818 | 0.78 | FAAH (0.88) | CASP3FAAHMGLLKAT2AKAT2B |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112961491-B | Antibacterial polyurethane foam material and preparation method thereof | 上海大学 | 2022-05-27 | — | — | CN | disclosed |
| CN-112961491-A | Antibacterial polyurethane foam material and preparation method thereof | 上海大学 | 2021-06-15 | — | — | CN | disclosed |