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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 6/20 | 0.33 |
| ▸ | THRA | P10827 | 5/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.33 |
| ▸ | CHRNA10 | Q9GZZ6 | 2/20 | 0.33 |
| ▸ | CHRNA9 | Q9UGM1 | 2/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | F7 | P08709 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 SCHEMBL23301130 | 0.87 | CA1 (0.34) | CA1CA2 | |
| Sulfuric Acid SCHEMBL30071055 | 0.77 | TDP1 (0.44) | CA1CA2 | |
| SCHEMBL23301461 | 0.75 | ALDH1A1 (0.38) | CA1CA2 | |
| Sulfuric Acid SCHEMBL30240036 | 0.75 | TDP1 (0.38) | CA1CA2 | |
| Hydrochloric Acid SCHEMBL23301430 | 0.74 | CA1 (0.39) | CA1CA2 | |
| Bromide SCHEMBL30070960 | 0.74 | ALDH1A1 (0.37) | CA1CA2 | |
| Iodide SCHEMBL30071069 | 0.74 | ALDH1A1 (0.37) | CA1CA2 | |
| Bromide SCHEMBL1883010 | 0.73 | CHRNA7 (0.46) | CHRNA7CHRNA10CHRNA9 | |
| Bromide SCHEMBL1886050 | 0.73 | KCNJ1 (0.46) | MEN1KMT2A | |
| Acetic Acid SCHEMBL16341976 | 0.72 | FDPS (0.37) | MEN1KMT2ACA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021083997-A1 | NOVEL MICELLAR CATALYSTS | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2021-05-06 | — | — | WO | disclosed |