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 | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.37 |
| ▸ | LCK | P06239 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL3255637 | 1.00 | MAPK1 (0.44) | MAPK1HSD17B10FFAR3LCKFYN | |
| Acetic Acid SCHEMBL2772542 | 1.00 | MAPK1 (0.44) | MAPK1HSD17B10FFAR3LCKFYN | |
| Acetic Acid SCHEMBL113972 | 1.00 | MAPK1 (0.44) | MAPK1HSD17B10FFAR3LCKFYN | |
| Acetic Acid SCHEMBL27775662 | 0.97 | MAPK1 (0.42) | MAPK1HSD17B10FFAR3LCKFYN | |
| Propylene Glycol SCHEMBL5485962 | 0.93 | TDP1 (0.46) | MAPK1HSD17B10FFAR3LCKFYN | |
| Propylene Glycol SCHEMBL29023295 | 0.93 | TDP1 (0.46) | MAPK1HSD17B10FFAR3LCKFYN | |
| Bicarbonate SCHEMBL28079320 | 0.92 | HSD17B10 (0.44) | MAPK1HSD17B10LMNATP53MAPT | |
| Acetone SCHEMBL3316535 | 0.92 | HSD17B10 (0.44) | MAPK1HSD17B10LMNAMAPTTDP1 | |
| Tetramethylammonium Ion SCHEMBL28134448 | 0.91 | MAPK1 (0.38) | MAPK1HSD17B10FFAR3LCKFYN | |
| Succinic Acid SCHEMBL15668485 | 0.91 | ALDH1A1 (0.43) | MAPK1HSD17B10FFAR3LMNAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1490501-B1 | ENZYMATIC RESOLUTION OF PROPYLENE GLYCOL ALKYL (OR ARYL) ETHERS AND ETHER ACETATES | REDDY S LAB EU LTD DR (GB) | 2010-05-26 | — | — | EP | disclosed |
| US-7264960-B2 | Enzymatic resolution of propylene glycol alkyl (or aryl) ethers and ether acetates | DOW GLOBAL TECHNOLOGIES INC. (US) | 2007-09-04 | — | — | US | disclosed |
| US-20050026260-A1 | Enzymatic resolution of propylene glycol alkyl (or aryl) ethers and ether acetates | RESNICK SOL M (US) | 2005-02-03 | — | — | US | disclosed |