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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.59 |
| ▸ | APAF1 | O14727 | 1/20 | 0.59 |
| ▸ | RECQL | P46063 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | MPO | P05164 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
| ▸ | ACE | P12821 | 3/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.53 |
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 SCHEMBL29660236 | 1.00 | KDM4E (0.59) | KDM4EMAPTL3MBTL1POLBAPAF1 | |
| SCHEMBL19966634 | 0.96 | KDM4E (0.60) | KDM4EMAPTL3MBTL1POLBAPAF1 | |
| SCHEMBL23100730 | 0.84 | KDM4E (0.68) | KDM4EMAPTL3MBTL1POLBAPAF1 | |
| SCHEMBL13973884 | 0.84 | KDM4E (0.63) | KDM4EMAPTL3MBTL1POLBAPAF1 | |
| SCHEMBL22607731 | 0.84 | KDM4E (0.68) | KDM4EMAPTL3MBTL1POLBAPAF1 | |
| SCHEMBL30117847 | 0.84 | KDM4E (0.68) | KDM4EMAPTL3MBTL1POLBAPAF1 | |
| SCHEMBL23381024 | 0.84 | ALOX15 (0.60) | POLBALOX15MEN1KMT2AACE | |
| SCHEMBL13448378 | 0.84 | KDM4E (0.60) | KDM4EMAPTL3MBTL1POLBAPAF1 | |
| SCHEMBL1407978 | 0.82 | ALOX15 (0.68) | POLBALOX15MEN1KMT2AACE | |
| SCHEMBL7849756 | 0.82 | ALDH1A1 (0.67) | KDM4EMAPTL3MBTL1POLBAPAF1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109661224-B | Compounds for reducing melanin content in cells | 联合利华知识产权控股有限公司 | 2022-05-24 | — | — | CN | claimed |
| EP-3509566-B1 | COMPOUNDS FOR REDUCING CELLULAR MELANIN CONTENT | UNILEVER NV (NL) | 2020-11-04 | — | — | EP | claimed |
| CN-109661224-B | Compounds for reducing melanin content in cells | 联合利华知识产权控股有限公司 | 2022-05-24 | — | — | CN | disclosed |
| EP-3509566-B1 | COMPOUNDS FOR REDUCING CELLULAR MELANIN CONTENT | UNILEVER NV (NL) | 2020-11-04 | — | — | EP | disclosed |