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 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 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 | |
|---|---|---|---|---|
| SCHEMBL380175 | 0.95 | — | — | |
| SCHEMBL3345529 | 0.91 | NR1H4 (0.31) | NR1H4 | |
| Fumaric Acid SCHEMBL7563314 | 0.79 | SMN1; SMN2 (0.40) | — | |
| Fumaric Acid SCHEMBL7563318 | 0.79 | SMN1; SMN2 (0.40) | — | |
| Acetic Acid SCHEMBL8519656 | 0.78 | TDP1 (0.40) | — | |
| SCHEMBL441100 | 0.75 | PPARA (0.38) | — | |
| SCHEMBL247553 | 0.75 | SLC7A5 (0.31) | — | |
| Crotonic Acid SCHEMBL8640256 | 0.74 | TDP1 (0.33) | — | |
| SCHEMBL9769680 | 0.74 | NR1H4 (0.39) | NR1H4 | |
| SCHEMBL246897 | 0.74 | TDP1 (0.40) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2627311-A1 | COSMETIC COMPOSITION COMPRISING A PARTICULAR SILICON DERIVATIVE AND ONE OR MORE ACRYLIC THICKENING POLYMERS | L'Oréal (FR) | 2013-08-21 | — | — | EP | disclosed |
| WO-2012049145-A1 | COSMETIC COMPOSITION COMPRISING A PARTICULAR SILICON DERIVATIVE AND ONE OR MORE ACRYLIC THICKENING POLYMERS | L'OREAL (FR) | 2012-04-19 | — | — | WO | disclosed |