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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.77 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | LPAR3 | Q9UBY5 | 3/20 | 0.48 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.48 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL28241382 | 0.93 | CYP3A4 (0.81) | CYP3A4TSHRLPAR3LPAR1LPAR2 | |
| Bicarbonate SCHEMBL28559959 | 0.93 | CYP3A4 (0.81) | CYP3A4TSHRLPAR3LPAR1LPAR2 | |
| Hydrogen Peroxide SCHEMBL27283190 | 0.93 | CYP3A4 (0.90) | CYP3A4TSHRLPAR3LPAR1LPAR2 | |
| Methyl Alcohol SCHEMBL28748149 | 0.88 | CYP3A4 (0.90) | CYP3A4TSHRLPAR3LPAR1LPAR2 | |
| SCHEMBL18570 | 0.88 | CYP3A4 (1.00) | CYP3A4TSHRLPAR3LPAR1LPAR2 | |
| SCHEMBL1020179 | 0.88 | CYP3A4 (1.00) | CYP3A4TSHRLPAR3LPAR1LPAR2 | |
| SCHEMBL27895927 | 0.88 | CYP3A4 (1.00) | CYP3A4TSHRLPAR3LPAR1LPAR2 | |
| Acetic Acid SCHEMBL29031609 | 0.87 | CYP3A4 (0.71) | CYP3A4TSHRLPAR3LPAR1LPAR2 | |
| Alcohol SCHEMBL9132791 | 0.86 | CYP3A4 (0.85) | CYP3A4TSHRLPAR3LPAR1LPAR2 | |
| Benzene SCHEMBL5436988 | 0.86 | CYP3A4 (0.85) | CYP3A4TSHR |
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-114621077-B | Industrial adipic acid preparation method and equipment | 中国科学院大连化学物理研究所 | 2023-07-25 | — | — | CN | disclosed |
| CN-106404702-B | The detection method of gold amount in a kind of quick measurement cyanating solution | 福建紫金矿冶测试技术有限公司 | 2018-09-28 | — | — | CN | disclosed |
| CN-106404702-A | Detection method for quickly determining gold content in cyanide solution | 福建紫金矿冶测试技术有限公司 | 2017-02-15 | — | — | CN | disclosed |