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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BID | P55957 | 3/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.38 |
| ▸ | PPARA | Q07869 | 3/20 | 0.38 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.38 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.38 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | EP300 | Q09472 | 1/20 | 0.38 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.38 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.38 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.38 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.38 |
| ▸ | CYSLTR2 | Q9NS75 | 5/20 | 0.37 |
| ▸ | CYSLTR1 | Q9Y271 | 5/20 | 0.37 |
| ▸ | CES2 | O00748 | 2/20 | 0.37 |
| ▸ | CES1 | P23141 | 2/20 | 0.37 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4650920 | 0.89 | LIPG (0.41) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL4652042 | 0.83 | CETP (0.36) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL4652036 | 0.83 | LIPG (0.37) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL247026 | 0.83 | LIPG (0.50) | BIDMCL1PPARABCL2L1BAK1 | |
| Trifluoromethanesulfonic Acid SCHEMBL5145136 | 0.81 | KCNH2 (0.44) | BIDMCL1BCL2L1BAK1 | |
| SCHEMBL3214972 | 0.80 | LIPG (0.50) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL31005121 | 0.80 | LIPG (0.50) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL7528453 | 0.79 | LIPG (0.46) | BIDMCL1BCL2L1BAK1KAT8 | |
| SCHEMBL8663469 | 0.77 | BID (0.46) | BIDMCL1PPARABCL2L1BAK1 | |
| SCHEMBL4618658 | 0.75 | GABRA1 (0.38) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2121857-A1 | SILICONE COATING COMPOSITION | AZ Electronic Materials USA Corp. (US) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008102256-A1 | SILICONE COATING COMPOSITION | AZ ELECTRONIC MATERIALS USA CORP. (DE) | 2008-08-28 | — | — | WO | disclosed |