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.
Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL28581417 | 0.89 | CES1 (0.32) | — | |
| SCHEMBL319284 | 0.88 | — | — | |
| Acetic Acid SCHEMBL28711246 | 0.87 | CES1 (0.31) | — | |
| Acetic Acid SCHEMBL29114969 | 0.86 | — | — | |
| Water SCHEMBL28383082 | 0.86 | — | — | |
| Bromide SCHEMBL28092799 | 0.86 | — | — | |
| Iodide SCHEMBL714909 | 0.86 | — | — | |
| Water SCHEMBL28029304 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL28228945 | 0.86 | — | — | |
| Bicarbonate SCHEMBL28731885 | 0.83 | CES2 (0.32) | — |
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-114853716-A | Technology and device for efficiently synthesizing alcohol esters by carbon dioxide | 北京石大油源科技开发有限公司 | 2022-08-05 | — | — | CN | claimed |
| CN-114853716-A | Technology and device for efficiently synthesizing alcohol esters by carbon dioxide | 北京石大油源科技开发有限公司 | 2022-08-05 | — | — | CN | disclosed |