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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 6/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL5173441 | 0.82 | LMNA (0.43) | BLMLMNA | |
| Acetic Acid SCHEMBL7164585 | 0.80 | ALDH1A1 (0.33) | CA1CA2ALDH1A1LMNA | |
| SCHEMBL574293 | 0.79 | LMNA (0.45) | BLMLMNA | |
| Acetic Acid SCHEMBL2468264 | 0.76 | CA1 (0.38) | CA1 | |
| Acetic Acid SCHEMBL2467666 | 0.76 | CES1 (0.41) | CA1CA2ALDH1A1 | |
| Acetic Acid SCHEMBL2466675 | 0.74 | CA1 (0.36) | CA1 | |
| Acetic Acid SCHEMBL2460295 | 0.74 | CES1 (0.42) | CA1CA2ALDH1A1 | |
| Acetic Acid SCHEMBL7163496 | 0.73 | — | — | |
| Acetic Acid SCHEMBL5999260 | 0.73 | CES1 (0.42) | CA1CA2ALDH1A1 | |
| Acetic Acid SCHEMBL2465385 | 0.73 | CA1 (0.40) | CA1ALDH1A1TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8013085-B2 | addition polymerization of ethylenically unsaturated monomers in an aqueous medium in the presence of polymer particles and at least one dispersant; polymer powders used as additives in adhesives, seals, plasters, renderings, paper coatings or paints | BASF AKTIENGESELLSCHAFT (DE) | 2011-09-06 | — | — | US | disclosed |
| US-20060264558-A1 | Method for the production of an aqueous polymer dispersion | BASF AKTIENGESELLSCHAFT (DE) | 2006-11-23 | — | — | US | disclosed |
| US-20040167259-A1 | Method for producing aqueous copolymer dispersions of copolymers consisting of carbon monoxide and olefinically unsaturated compounds | BASF AKTIENGESELLSCHAFT (DE) | 2004-08-26 | — | — | US | disclosed |