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 SCHEMBL4649683 | 0.96 | FFAR3 (0.58) | — | |
| Acetic Acid SCHEMBL195596 | 0.96 | — | — | |
| Acetic Acid SCHEMBL10483716 | 0.92 | FFAR3 (0.54) | — | |
| Acetone SCHEMBL593743 | 0.84 | — | — | |
| Dimethyl Sulfoxide SCHEMBL28074527 | 0.80 | — | — | |
| Dimethyl Sulfoxide SCHEMBL11034597 | 0.80 | — | — | |
| Acetic Acid SCHEMBL2848522 | 0.78 | FFAR3 (0.88) | — | |
| Acetic Acid SCHEMBL21596426 | 0.78 | FFAR3 (0.88) | — | |
| Acetic Acid SCHEMBL462200 | 0.78 | FFAR3 (0.88) | — | |
| Acetic Acid SCHEMBL21197465 | 0.78 | FFAR3 (0.88) | — |
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-112209847-B | Method for preparing amide compound under catalysis of ionic liquid in high-pressure environment | 烟台大学 | 2022-12-23 | — | — | CN | disclosed |
| CN-112209847-A | Method for preparing amide compound under catalysis of ionic liquid in high-pressure environment | 烟台大学 | 2021-01-12 | — | — | CN | disclosed |