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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.59 |
| ▸ | MEN1 | O00255 | 3/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | G6PD | P11413 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8322730 | 0.92 | MEN1 (0.68) | KMT2AMEN1KDM4EGAAPOLB | |
| Acetic Acid SCHEMBL6714814 | 0.81 | MEN1 (0.66) | KMT2AMEN1KDM4EGAATSHR | |
| Acetic Acid SCHEMBL8322779 | 0.79 | MEN1 (0.62) | KMT2AMEN1KDM4EGAAPOLB | |
| SCHEMBL7524997 | 0.78 | MEN1 (0.54) | KMT2AMEN1KDM4EGAAPOLB | |
| SCHEMBL5308861 | 0.75 | MEN1 (0.66) | KMT2AMEN1KDM4EGAAPOLB | |
| SCHEMBL12309773 | 0.74 | MEN1 (0.56) | KMT2AMEN1KDM4EGAAPOLB | |
| SCHEMBL9542251 | 0.74 | GAA (0.71) | KMT2AMEN1KDM4EGAAPOLB | |
| SCHEMBL2977343 | 0.73 | GAA (0.54) | KMT2AMEN1KDM4EGAAPOLB | |
| SCHEMBL3207946 | 0.73 | MEN1 (0.62) | KMT2AMEN1KDM4EGAAPOLB | |
| SCHEMBL5669243 | 0.71 | TSHR (0.59) | KMT2AMEN1KDM4EMAPK1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5929112-A | USE IN PHARMACEUTICALS OR COSMETICS AS ANTIOXIDANTS, IMPROVED BIOAVAILABILITY | L'OREAL (FR) | 1999-07-27 | — | — | US | disclosed |