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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 2/20 | 0.39 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 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 SCHEMBL11232036 | 1.00 | FFAR3 (0.39) | FFAR3LCKFYNALDH1A1TSHR | |
| Acetic Acid SCHEMBL3337776 | 0.97 | FFAR3 (0.41) | FFAR3LCKFYNALDH1A1TSHR | |
| Acetic Acid SCHEMBL11608458 | 0.97 | FFAR3 (0.41) | FFAR3LCKFYNALDH1A1TSHR | |
| Acetic Acid SCHEMBL28409285 | 0.94 | FFAR3 (0.39) | FFAR3LCKFYNALDH1A1TSHR | |
| Acetic Acid SCHEMBL9691028 | 0.94 | FFAR3 (0.39) | FFAR3LCKFYNALDH1A1TSHR | |
| Acetic Acid SCHEMBL5392613 | 0.88 | FFAR3 (0.50) | FFAR3LCKFYNTSHRTDP1 | |
| Acetic Acid SCHEMBL6363977 | 0.88 | FFAR3 (0.50) | FFAR3LCKFYNTSHRTDP1 | |
| Acetic Acid SCHEMBL11441619 | 0.88 | FFAR3 (0.50) | FFAR3LCKFYNTSHRTDP1 | |
| Acetic Acid SCHEMBL157959 | 0.88 | FFAR3 (0.50) | FFAR3LCKFYNTSHRTDP1 | |
| Acetic Acid SCHEMBL28529621 | 0.88 | FFAR3 (0.50) | FFAR3LCKFYNTSHRTDP1 |
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-111164194-B | Structured unit dose cleaning products | 路博润先进材料公司 | 2022-10-25 | — | — | CN | disclosed |