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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM6B | O15054 | 1/20 | 0.37 |
| ▸ | KDM5C | P41229 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.37 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.37 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL545157 | 0.93 | — | — | |
| Methacrylic Acid SCHEMBL3224578 | 0.91 | ALDH1A1 (0.44) | ALDH1A1KDM6BKDM5CEGLN1PHF8 | |
| Chloromethane SCHEMBL28663449 | 0.88 | ALDH1A1 (0.46) | ALDH1A1KDM6BKDM5CEGLN1PHF8 | |
| SCHEMBL28029837 | 0.84 | ALDH1A1 (0.48) | ALDH1A1KDM6BKDM5CEGLN1PHF8 | |
| SCHEMBL25410111 | 0.80 | ALDH1A1 (0.42) | ALDH1A1KDM6BKDM5CEGLN1PHF8 | |
| SCHEMBL27773769 | 0.73 | ALDH1A1 (0.35) | ALDH1A1KDM6BKDM5CEGLN1PHF8 | |
| Methacrylic Acid SCHEMBL4594667 | 0.73 | KDM6B (0.35) | ALDH1A1KDM6BKDM5CEGLN1PHF8 | |
| SCHEMBL1401727 | 0.73 | KDM6B (0.43) | ALDH1A1KDM6BKDM5CEGLN1PHF8 | |
| Acetic Acid SCHEMBL2896489 | 0.71 | ALDH1A1 (0.55) | ALDH1A1TSHRTHRBFFAR3LCK | |
| Acetic Acid SCHEMBL28803626 | 0.71 | ALDH1A1 (0.55) | ALDH1A1TSHRTHRBFFAR3LCK |
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 |
|---|---|---|---|---|---|---|---|
| CN-100412099-C | Compound modified starch flocculating agent and equipment thereof | YANMAO DONG (CN) | 2008-08-20 | — | — | CN | disclosed |