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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A1 | O15245 | 3/20 | 0.50 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.48 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 SCHEMBL21384662 | 0.95 | DNM1 (0.54) | SLC22A1DNM1SLC22A2CES1CA1 | |
| Acetic Acid SCHEMBL30698150 | 0.95 | SLC22A1 (0.50) | SLC22A1DNM1SLC22A2CES1CA1 | |
| Acetic Acid SCHEMBL7546512 | 0.94 | DNM1 (0.60) | SLC22A1DNM1SLC22A2CES1CES2 | |
| Acetic Acid SCHEMBL10821209 | 0.91 | DNM1 (0.62) | SLC22A1DNM1SLC22A2CES1CES2 | |
| Acetic Acid SCHEMBL3180706 | 0.91 | DNM1 (0.62) | SLC22A1DNM1SLC22A2CES1CES2 | |
| Tetrabuthylammonium SCHEMBL36122 | 0.90 | SLC22A1 (0.63) | SLC22A1DNM1SLC22A2CES1CES2 | |
| Tetrabuthylammonium SCHEMBL9119754 | 0.90 | SLC22A1 (0.63) | SLC22A1DNM1SLC22A2CES1CES2 | |
| Tetrabuthylammonium SCHEMBL29563334 | 0.90 | SLC22A1 (0.63) | SLC22A1DNM1SLC22A2CES1CES2 | |
| Tetrabuthylammonium SCHEMBL9118025 | 0.90 | SLC22A1 (0.63) | SLC22A1DNM1SLC22A2CES1CES2 | |
| Bicarbonate SCHEMBL2275966 | 0.88 | DNM1 (0.56) | SLC22A1DNM1SLC22A2CES1CA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024004508-A1 | METHOD FOR PRODUCING POLYSACCHARIDE FIBER | 旭化成株式会社 | 2024-01-04 | — | — | WO | disclosed |