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 | 5/20 | 0.44 |
| ▸ | ALPL | P05186 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ALPG | P10696 | 1/20 | 0.44 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 5/20 | 0.40 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
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 SCHEMBL28038336 | 0.97 | ALDH1A1 (0.44) | ALDH1A1ALPLPOLBALPGBBOX1 | |
| Bicarbonate SCHEMBL8962371 | 0.97 | ALDH1A1 (0.44) | ALDH1A1ALPLPOLBALPGBBOX1 | |
| Bicarbonate SCHEMBL28038338 | 0.93 | ALDH1A1 (0.46) | ALDH1A1ALPLPOLBALPGBBOX1 | |
| Succinic Acid SCHEMBL7270166 | 0.92 | BBOX1 (0.51) | ALDH1A1ALPLPOLBALPGBBOX1 | |
| SCHEMBL9567755 | 0.90 | ALDH1A1 (0.40) | ALDH1A1ALPLPOLBALPGBBOX1 | |
| SCHEMBL130071 | 0.89 | ALDH1A1 (0.50) | ALDH1A1KDM4ETDP1CHRM2CHRNA7 | |
| Mucic Acid SCHEMBL17534991 | 0.88 | ALPL (0.44) | ALDH1A1ALPLPOLBALPGBBOX1 | |
| SCHEMBL16781188 | 0.88 | ALDH1A1 (0.54) | ALDH1A1KDM4ETDP1CHRM2CHRNA7 | |
| Water SCHEMBL2110702 | 0.88 | ALDH1A1 (0.48) | ALDH1A1KDM4ETDP1CHRM2CHRNA7 | |
| Fluoride Ion SCHEMBL6316238 | 0.88 | ALDH1A1 (0.48) | ALDH1A1KDM4ETDP1CHRM2CHRNA7 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11085124-B2 | Electrochemical reaction device | KABUSHIKI KAISHA TOSHIBA (JP) | 2021-08-10 | — | — | US | disclosed |
| US-20060115506-A1 | Compositions and method of wood preservation | HARMER MARK A | 2006-06-01 | — | — | US | disclosed |
| EP-1464630-B1 | Aqueous coating liquid for forming a magnesium oxide film | NOF CORP (JP) | 2006-05-10 | — | — | EP | disclosed |
| US-6911072-B2 | Aqueous coating liquid for forming a magnesium oxide film | NOF CORPORATION (JP) | 2005-06-28 | — | — | US | disclosed |
| US-20040247505-A1 | Aqueous coating liquid for forming a magnesium oxide film | NOF CORPORATION (JP) | 2004-12-09 | — | — | US | disclosed |
| EP-1464630-A1 | Aqueous coating liquid for forming a magnesium oxide film | NOF CORPORATION (JP) | 2004-10-06 | — | — | EP | disclosed |
| US-4311512-A | Bactericidal water-soluble complexes | POLYCRAFT LABORATORIES, INC., A CORP. OF NJ. | 1982-01-19 | — | — | US | disclosed |