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 | |
|---|---|---|---|---|
| ▸ | ESR1 known ✓ | P03372 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | LGALS8 | O00214 | 2/20 | 0.36 |
| ▸ | PYGB | P11216 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL42791 | 0.97 | MAPK1 (0.64) | MAPK1NOD2ALDH1A1THRBKDR | |
| SCHEMBL30987364 | 0.97 | MAPK1 (0.64) | MAPK1NOD2ALDH1A1THRBKDR | |
| SCHEMBL20533512 | 0.97 | MAPK1 (0.64) | MAPK1NOD2ALDH1A1THRBKDR | |
| SCHEMBL16241534 | 0.97 | MAPK1 (0.64) | MAPK1NOD2ALDH1A1THRBKDR | |
| SCHEMBL17184967 | 0.97 | MAPK1 (0.64) | MAPK1NOD2ALDH1A1THRBKDR | |
| SCHEMBL42792 | 0.97 | MAPK1 (0.64) | MAPK1NOD2ALDH1A1THRBKDR | |
| SCHEMBL2728425 | 0.97 | MAPK1 (0.64) | MAPK1NOD2ALDH1A1THRBKDR | |
| SCHEMBL22163862 | 0.97 | MAPK1 (0.64) | MAPK1NOD2ALDH1A1THRBKDR | |
| SCHEMBL16241536 | 0.97 | MAPK1 (0.64) | MAPK1NOD2ALDH1A1THRBKDR | |
| SCHEMBL33302 | 0.97 | MAPK1 (0.64) | MAPK1NOD2ALDH1A1THRBKDR |
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-108066364-A | Synthetic camel organ extract, its preparation method and application | 兰多夫·里姆施耐德 | 2018-05-25 | — | — | CN | disclosed |