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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28778911 | 0.93 | — | — | |
| SCHEMBL22712806 | 0.81 | — | — | |
| SCHEMBL371079 | 0.74 | — | — | |
| SCHEMBL503383 | 0.74 | — | — | |
| SCHEMBL503376 | 0.74 | — | — | |
| Acetic Acid SCHEMBL5616729 | 0.74 | KDM4E (0.34) | ALDH1A1TSHRHTT | |
| SCHEMBL30651 | 0.73 | ALDH1A1 (0.42) | ALDH1A1TSHRHTT | |
| Hydrochloric Acid SCHEMBL74583 | 0.73 | GGT1 (0.42) | ALDH1A1TSHRHTTFYN | |
| Acetic Acid SCHEMBL8947198 | 0.73 | TET2 (0.43) | ALDH1A1TSHRHTTFFAR3LCK | |
| Water SCHEMBL7508586 | 0.73 | GGT1 (0.42) | ALDH1A1TSHRHTTFYN |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0923639-A2 | AQUEOUS AEROSOL CLEANING COMPOSITIONS PROVIDING WATER AND OIL REPELLENCY TO FIBER SUBSTRATES | Reckitt Benckiser Inc. (US) | 1999-06-23 | — | — | EP | disclosed |
| US-5861365-A | FLUOROALKYL POLYOXYALKYLENE COMPOUND, A POLYACID OR AMINE, ANIONIC SURFACTANTS WITH SOLVENT, CITRIC ACID SALT AND WATER | RECKITT & COLMAN INC. (US) | 1999-01-19 | — | — | US | disclosed |
| WO-1998004673-A2 | AQUEOUS AEROSOL CLEANING COMPOSITIONS PROVIDING WATER AND OIL REPELLENCY TO FIBER SUBSTRATES | RECKITT & COLMAN INC. (US) | 1998-02-05 | — | — | WO | disclosed |
| US-5712240-A | Aqueous cleaning compositions providing water and oil repellency to fiber substrates | RECKITT & COLMAN INC. (US) | 1998-01-27 | — | — | US | disclosed |
| EP-0803567-A2 | Aqueous cleaning composition providing water and oil repellency to fibre substrates | Reckitt & Colman Inc. (US) | 1997-10-29 | — | — | EP | disclosed |