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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.64 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.64 |
| ▸ | IAPP | P10997 | 5/20 | 0.61 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | BID | P55957 | 3/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.45 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.45 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.45 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | EP300 | Q09472 | 1/20 | 0.45 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.45 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.45 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.45 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.45 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
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 SCHEMBL8910358 | 0.94 | GABRA1 (0.67) | GABRA1GABRB2IAPPAKR1B1BID | |
| SCHEMBL30023472 | 0.91 | GABRA1 (0.76) | GABRA1GABRB2IAPPADAMTS4ALDH1A1 | |
| SCHEMBL70065 | 0.91 | GABRA1 (0.76) | GABRA1GABRB2IAPPADAMTS4ALDH1A1 | |
| Bromide SCHEMBL11072545 | 0.89 | GABRA1 (0.73) | GABRA1GABRB2IAPPADAMTS4ALDH1A1 | |
| Glycolic Acid SCHEMBL28495550 | 0.88 | GABRA1 (0.59) | GABRA1GABRB2IAPPAKR1B1BID | |
| Formaldehyde SCHEMBL27752499 | 0.87 | GABRA1 (0.70) | GABRA1GABRB2IAPPADAMTS4ALDH1A1 | |
| Acetic Acid SCHEMBL28002759 | 0.86 | IAPP (0.66) | IAPPBIDMCL1BCL2L1BAK1 | |
| SCHEMBL5967671 | 0.85 | GABRA1 (0.67) | GABRA1GABRB2IAPPADAMTS4ALDH1A1 | |
| Phosphoric Acid SCHEMBL466514 | 0.83 | GABRA1 (0.64) | GABRA1GABRB2IAPPADAMTS4ALDH1A1 | |
| Acetic Acid SCHEMBL27895243 | 0.83 | AKR1B1 (0.61) | GABRA1GABRB2IAPPAKR1B1BID |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117427105-A | Application of ethyl catechin acetate extract in treating allergic rhinitis | 金建波 | 2024-01-23 | — | — | CN | claimed |