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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 5/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2150540 | 0.89 | — | — | |
| Acetic Acid SCHEMBL2136672 | 0.80 | ALDH1A1 (0.56) | ALDH1A1ATMHCAR2GPR84FFAR1 | |
| Acetic Acid SCHEMBL4733805 | 0.79 | ALDH1A1 (0.46) | ALDH1A1ATMHCAR2GPR84FFAR1 | |
| SCHEMBL28222922 | 0.74 | ALDH1A1 (0.44) | ALDH1A1ATMHCAR2GPR84FFAR1 | |
| Acetic Acid SCHEMBL8837633 | 0.73 | ALDH1A1 (0.56) | ALDH1A1ATMHCAR2HPGDTSHR | |
| SCHEMBL7717215 | 0.73 | — | — | |
| Hexane SCHEMBL607219 | 0.73 | GPR84 (0.52) | ALDH1A1GPR84FFAR1TSHRALOX15 | |
| Pentane SCHEMBL18429443 | 0.73 | GPR84 (0.46) | ALDH1A1GPR84FFAR1TSHRALOX15 | |
| Bicarbonate SCHEMBL1538407 | 0.73 | ALDH1A1 (0.52) | ALDH1A1ATMHCAR2GPR84FFAR1 | |
| Acetone SCHEMBL8477263 | 0.73 | ALDH1A1 (0.59) | ALDH1A1ATMHCAR2CES2HPGD |
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-114126748-B | Systems and methods for preparing microspheres and emulsions | 奥克伍德实验室有限责任公司 | 2024-06-04 | — | — | CN | disclosed |
| CN-114126748-A | Systems and methods for preparing microspheres and emulsions | 奥克伍德实验室有限责任公司 | 2022-03-01 | — | — | CN | disclosed |