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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 4/20 | 0.46 |
| ▸ | KCNJ1 | P48048 | 2/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 2/20 | 0.36 |
| ▸ | BRD2 | P25440 | 1/20 | 0.36 |
| ▸ | FNTA | P49354 | 1/20 | 0.34 |
| ▸ | FNTB | P49356 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | MIF | P14174 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL13435235 | 0.78 | GLS (0.41) | KCNJ1NOTUMBRD4BRD2MIF | |
| SCHEMBL16579400 | 0.78 | NOTUM (0.52) | KCNJ1NOTUMBRD4BRD2MIF | |
| SCHEMBL17107883 | 0.74 | TERT (0.41) | KCNJ1NOTUMBRD4BRD2FNTA | |
| SCHEMBL21424267 | 0.72 | EPHX2 (0.48) | ALDH1A1 | |
| SCHEMBL13872481 | 0.71 | KCNJ1 (0.56) | KCNJ1BRD4HSD17B10MIFKDM4E | |
| SCHEMBL22917015 | 0.71 | KCNJ1 (0.40) | KCNJ1 | |
| SCHEMBL22276769 | 0.70 | MIF (0.62) | KCNJ1BRD4MIFNTRK1KDM4E | |
| SCHEMBL17107880 | 0.70 | WNT1 (0.46) | HSD17B10KDM4EALDH1A1 | |
| SCHEMBL23564883 | 0.69 | KCNJ1 (0.36) | KCNJ1NOTUMBRD4BRD2MIF | |
| SCHEMBL21423960 | 0.66 | KDM4E (0.41) | NOTUMHSD17B10KDM4EALDH1A1 |
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-110483335-B | Amyloid targeting agents and methods of use thereof | 阿米达斯公司 | 2023-08-11 | — | — | CN | disclosed |