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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL1230066 | 0.94 | FFAR3 (0.88) | — | |
| Acetic Acid SCHEMBL28308127 | 0.94 | — | — | |
| Acetic Acid SCHEMBL3432477 | 0.94 | FFAR3 (0.88) | — | |
| Acetic Acid SCHEMBL712 | 0.94 | — | — | |
| Acetic Acid SCHEMBL9564747 | 0.94 | FFAR3 (0.88) | — | |
| Acetic Acid SCHEMBL8328631 | 0.94 | — | — | |
| Acetic Acid SCHEMBL11699356 | 0.89 | FFAR3 (0.78) | — | |
| Acetic Acid SCHEMBL2834525 | 0.89 | — | — | |
| Acetic Acid SCHEMBL10694918 | 0.89 | — | — | |
| Acetic Acid SCHEMBL9176342 | 0.89 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0028407-B1 | PREPARATION OF 5-(HALOPHENYL)SALICYLIC ACID COMPOUNDS | MERCK & CO. INC. (US) | 1983-09-07 | — | — | EP | disclosed |
| US-4355174-A | IN A PALLADIUM CATALYST SYSTEM | MERCK & CO., INC. (US) | 1982-10-19 | — | — | US | disclosed |