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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 5/20 | 0.79 |
| ▸ | NOS3 | P29474 | 4/20 | 0.79 |
| ▸ | NOS1 | P29475 | 1/20 | 0.79 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.40 |
| ▸ | TKT | P29401 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29435528 | 0.89 | — | — | |
| SCHEMBL17639 | 0.89 | — | — | |
| SCHEMBL3181216 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL8812851 | 0.87 | — | — | |
| SCHEMBL27768617 | 0.87 | — | — | |
| SCHEMBL1181839 | 0.85 | NOS2 (0.83) | NOS2NOS3NOS1PLAUNAPRT | |
| Bromide SCHEMBL29506576 | 0.85 | NOS2 (0.91) | NOS2NOS3NOS1PLAUNAPRT | |
| SCHEMBL6859312 | 0.81 | NOS2 (0.83) | NOS2NOS3NOS1PLAUNAPRT | |
| Ammonia Solution, Strong SCHEMBL3174065 | 0.79 | NOS2 (0.79) | NOS2NOS3NOS1PLAUNAPRT | |
| Acetic Acid Methyl Ester SCHEMBL28120374 | 0.77 | NOS3 (0.68) | NOS2NOS3NOS1PLAUNAPRT |
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-115340493-A | 2-aminopyridine Schiff base and preparation method and application thereof | 江苏海洋大学 | 2022-11-15 | — | — | CN | disclosed |