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 | |
|---|---|---|---|---|
| SCHEMBL27579820 | 0.90 | — | — | |
| Acetic Acid SCHEMBL27832217 | 0.74 | — | — | |
| SCHEMBL30723274 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL28019940 | 0.71 | — | — | |
| SCHEMBL30057701 | 0.69 | — | — | |
| Lactic Acid SCHEMBL27658241 | 0.69 | TP53 (0.38) | — | |
| Acetic Acid SCHEMBL28427571 | 0.69 | GBA2 (0.34) | — | |
| Acetic Acid SCHEMBL27891397 | 0.69 | NPC1 (0.33) | — | |
| Bicarbonate SCHEMBL28058350 | 0.69 | — | — | |
| SCHEMBL623092 | 0.69 | ALDH1A1 (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112439453-B | Preparation method of catalyst for vinyl acetate by acetylene method | 中国石油化工股份有限公司 | 2023-07-04 | — | — | CN | disclosed |
| CN-112439463-A | Regeneration method of waste catalyst for acetylene method vinyl acetate | 中国石油化工股份有限公司 | 2021-03-05 | — | — | CN | disclosed |
| CN-112439453-A | Preparation method of catalyst for vinyl acetate by acetylene method | 中国石油化工股份有限公司 | 2021-03-05 | — | — | CN | disclosed |