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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PAM | P19021 | 1/20 | 0.34 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 4/20 | 0.30 |
| ▸ | GABRD | O14764 | 4/20 | 0.30 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.30 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.30 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.30 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.30 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.30 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.30 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.30 |
| ▸ | GABRA4 | P48169 | 4/20 | 0.30 |
| ▸ | GABRE | P78334 | 4/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL586254 | 0.95 | — | — | |
| SCHEMBL12973054 | 0.95 | — | — | |
| SCHEMBL1130559 | 0.95 | — | — | |
| SCHEMBL1781885 | 0.80 | — | — | |
| SCHEMBL1781884 | 0.80 | — | — | |
| SCHEMBL15080408 | 0.80 | — | — | |
| SCHEMBL8755819 | 0.79 | ALDH1A1 (0.48) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL8755829 | 0.79 | ALDH1A1 (0.48) | ALDH1A1CYP2D6ALOX15PAM | |
| SCHEMBL29894068 | 0.78 | ALOX15 (0.44) | ALDH1A1CYP2D6ALOX15 | |
| SCHEMBL8733627 | 0.78 | — | — |
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-118234470-B | Perfuming complex of natural origin, perfuming composition and aqueous fragrance composition | 伊碧申香料有限公司 | 2025-03-07 | — | — | CN | disclosed |
| CN-118234470-A | Perfuming complex of natural origin, perfuming composition and aqueous fragrance composition | 伊碧申香料有限公司 | 2024-06-21 | — | — | CN | disclosed |