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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 6/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 6/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Methacrylic Acid SCHEMBL27657709 | 0.88 | TSHR (0.43) | ALDH1A1ATMCES1CA1CES2 | |
| Acetoacetic Acid SCHEMBL27893162 | 0.86 | ALDH1A1 (0.41) | ALDH1A1ATMCES1CA1CES2 | |
| Butyric Acid SCHEMBL30339117 | 0.85 | FFAR3 (0.56) | ALDH1A1CES1CA1CES2 | |
| SCHEMBL2514425 | 0.85 | ALDH1A1 (0.39) | ALDH1A1ATMCES1CA1CES2 | |
| Bromide SCHEMBL7113541 | 0.80 | ADRB2 (0.43) | ALDH1A1ATMCA1TSHRHPGD | |
| Fluoride Ion SCHEMBL7112112 | 0.80 | ADRB2 (0.43) | ALDH1A1ATMCA1TSHRHPGD | |
| Hydrochloric Acid SCHEMBL7113566 | 0.80 | ADRB2 (0.43) | ALDH1A1ATMCA1TSHRHPGD | |
| SCHEMBL29408744 | 0.78 | CA1 (0.38) | ALDH1A1ATMCES1CA1CES2 | |
| SCHEMBL17106051 | 0.78 | HAO1 (0.47) | CES1CA1CES2 | |
| Acetic Acid SCHEMBL1262288 | 0.76 | TSHR (0.54) | ALDH1A1ATMCES1CA1CES2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1634933-A1 | Coating composition for protectiing automobile surfaces and coating method | Rock Field Company (JP) | 2006-03-15 | — | — | EP | disclosed |