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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 SCHEMBL2863906 | 0.89 | KMT2A (0.40) | KMT2AMAPTALDH1A1MEN1GAA | |
| Acetic Acid SCHEMBL986789 | 0.89 | KMT2A (0.40) | KMT2AMAPTALDH1A1MEN1GAA | |
| Acetic Acid SCHEMBL988122 | 0.87 | SMN1; SMN2 (0.46) | SMN1; SMN2KMT2AALDH1A1MEN1GAA | |
| SCHEMBL85990 | 0.80 | GAA (0.38) | KMT2AMAPTALDH1A1MEN1GAA | |
| Acetic Acid SCHEMBL2854448 | 0.80 | KMT2A (0.36) | KMT2AMAPTALDH1A1MEN1GAA | |
| Hydrochloric Acid SCHEMBL7516042 | 0.78 | GAA (0.37) | KMT2AMAPTALDH1A1MEN1GAA | |
| Ethylene SCHEMBL3939551 | 0.76 | GAA (0.36) | KMT2AMAPTALDH1A1MEN1GAA | |
| SCHEMBL14237283 | 0.76 | GAA (0.47) | SMN1; SMN2KMT2AALDH1A1MEN1GAA | |
| SCHEMBL38953 | 0.76 | SMN1; SMN2 (0.56) | SMN1; SMN2KMT2AALDH1A1MEN1MAPK1 | |
| Water SCHEMBL7733637 | 0.73 | SMN1; SMN2 (0.54) | SMN1; SMN2KMT2AALDH1A1MEN1MAPK1 |
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-1680541-B1 | STABILIZED BODY CARE PRODUCTS, HOUSEHOLD PRODUCTS, TEXTILES AND FABRICS | BASF SE (DE) | 2012-12-19 | — | — | EP | claimed |