Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL28209546 | 0.89 | ALOX15 (0.36) | — | |
| SCHEMBL37249 | 0.82 | — | — | |
| SCHEMBL17746590 | 0.78 | CA2 (0.34) | — | |
| Phosphoric Acid SCHEMBL17746584 | 0.78 | MMP1 (0.39) | — | |
| Dimethylamine SCHEMBL28096048 | 0.76 | — | — | |
| Phosphoramidic Acid SCHEMBL6036883 | 0.74 | MMP1 (0.36) | — | |
| Trimethylammonium SCHEMBL27491056 | 0.73 | — | — | |
| Acetic Acid SCHEMBL5551627 | 0.72 | ALDH1A1 (0.34) | — | |
| Acetic Acid SCHEMBL6419058 | 0.72 | FFAR3 (0.54) | — | |
| Trimethylammonium SCHEMBL27496937 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007063327-A1 | HYDROXYLAMMONIUM SALTS AS IONIC LIQUIDS | BIONIQS LIMITED (GB) | 2007-06-07 | — | — | WO | disclosed |