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 | |
|---|---|---|---|---|
| ▸ | DDR1 | Q08345 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL876019 | 0.88 | CYP19A1 (0.43) | ALDH1A1HTTCYP19A1L3MBTL1TDP1 | |
| Propionic Acid SCHEMBL28134495 | 0.86 | AGBL2 (0.45) | DDR1ALDH1A1GAAHTTL3MBTL1 | |
| Hydrochloric Acid SCHEMBL27566786 | 0.86 | CYP19A1 (0.42) | ALDH1A1HTTCYP19A1L3MBTL1TDP1 | |
| Acetic Acid SCHEMBL28557709 | 0.84 | HCAR2 (0.47) | DDR1ALDH1A1GAACYP19A1HCAR2 | |
| Cyanide SCHEMBL27815567 | 0.82 | CYP19A1 (0.43) | ALDH1A1HTTCYP19A1L3MBTL1TDP1 | |
| Acetamide SCHEMBL28112655 | 0.82 | ALDH1A1 (0.47) | DDR1ALDH1A1GAAHTTHCAR2 | |
| SCHEMBL29112035 | 0.82 | GABRA2 (0.36) | DDR1ALDH1A1GAAHTTL3MBTL1 | |
| Formic Acid SCHEMBL28229618 | 0.81 | LMNA (0.42) | ALDH1A1GAAHTTCYP19A1L3MBTL1 | |
| Acetonitrile SCHEMBL27979099 | 0.81 | CYP11B1 (0.42) | DDR1ALDH1A1GAAHTTCYP19A1 | |
| SCHEMBL29111925 | 0.81 | CYP19A1 (0.39) | DDR1ALDH1A1HTTCYP19A1L3MBTL1 |
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-115215793-A | Synthesis method of fluopyram | 南开大学 | 2022-10-21 | — | — | CN | disclosed |