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 | 0.38 |
| ▸ | ESR2 known ✓ | Q92731 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | CASP1 | P29466 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.41 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
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 SCHEMBL755557 | 0.90 | CHEK1 (0.41) | NQO2MAPTKDM4EALDH1A1CASP1 | |
| Hydrochloric Acid SCHEMBL40555 | 0.87 | MAPT (0.50) | MAPTKDM4EALDH1A1CASP1HSD17B10 | |
| SCHEMBL30165715 | 0.85 | KMT2A (0.50) | MAPTKDM4EALDH1A1CASP1HSD17B10 | |
| SCHEMBL146313 | 0.85 | KMT2A (0.50) | MAPTKDM4EALDH1A1CASP1HSD17B10 | |
| Iodide SCHEMBL11279046 | 0.83 | KMT2A (0.48) | MAPTKDM4EALDH1A1CASP1HSD17B10 | |
| SCHEMBL12620639 | 0.79 | KDM4E (0.43) | NQO2MAPTKDM4EALDH1A1CASP1 | |
| SCHEMBL11281816 | 0.79 | ALDH1A1 (0.44) | MAPTKDM4EALDH1A1CASP1HSD17B10 | |
| Hydrochloric Acid SCHEMBL7599787 | 0.77 | MAPT (0.39) | MAPTKDM4EALDH1A1CASP1HSD17B10 | |
| Hydrochloric Acid SCHEMBL333986 | 0.77 | KDM4E (0.39) | MAPTKDM4EALDH1A1CASP1HSD17B10 | |
| Hydrochloric Acid SCHEMBL29594522 | 0.77 | APAF1 (0.46) | MAPTKDM4EALDH1A1CASP1HSD17B10 |
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 167 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2450026-B1 | DENTAL COMPOSITION HAVING A REDOX INDICATOR AND METHOD OF USING SAME | KERR CORP (US) | 2023-03-15 | — | — | EP | claimed |
| EP-2450027-B1 | DENTAL COMPOSITIONS HAVING SPECIAL FUNCTIONALITY AND TRI-BARREL PACKAGING | KERR CORP (US) | 2023-01-11 | — | — | EP | claimed |
| US-20220273813-A1 | PHOTOSENSITIZER-CONJUGATED ANTIMICROBIAL CELLULOSE NANOCRYSTALS AND METHODS OF SYNTHESIZING AND USING SAME | HNU MATERIALS INC. (CA) | 2022-09-01 | — | — | US | claimed |
| EP-4021514-A1 | PHOTOSENSITIZER-CONJUGATED ANTIMICROBIAL CELLULOSE NANOCRYSTALS AND METHODS OF SYNTHESIZING AND USING SAME | HNU Materials Inc. (CA) | 2022-07-06 | — | — | EP | claimed |
| WO-2021035349-A1 | PHOTOSENSITIZER-CONJUGATED ANTIMICROBIAL CELLULOSE NANOCRYSTALS AND METHODS OF SYNTHESIZING AND USING SAME | HEYNE BELINDA (CA) | 2021-03-04 | — | — | WO | claimed |
| US-9522099-B2 | Dental compositions having special functionality and a tri-barrel packaging and delivery system therefor | KERR CORPORATION (US) | 2016-12-20 | — | — | US | claimed |
| US-9399004-B2 | Dental composition having a redox indicator and method of using same | KERR CORPORATION (US) | 2016-07-26 | — | — | US | claimed |
| CN-105004775-B | Curing object point/nanometer sheet compound DNA electrochemical probe and its preparation method and application | QINGDAO UNIVERSITY (CN) | 2016-02-03 | — | — | CN | claimed |
| CN-102812348-B | Analysis quality testing based on SERS is surveyed | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2016-02-03 | — | — | CN | claimed |
| CN-105004775-A | Preparation method of disulfide dot/nanosheet compound DNA electrochemical probe | UNIV QINGDAO | 2015-10-28 | — | — | CN | claimed |
| CN-102812348-A | SERS-based Analyte Detection | AGENCY SCIENCE TECH & RES | 2012-12-05 | — | — | CN | claimed |
| CN-101149384-B | Device for detecting avian influenza virus antigen and detection method | UNIV ZHEJIANG GONGSHANG | 2012-10-31 | — | — | CN | claimed |
| CN-101149383-B | Device for detecting avian influenza virus antibody and detection method | UNIV ZHEJIANG GONGSHANG | 2012-07-18 | — | — | CN | claimed |
| US-20120115106-A1 | DENTAL COMPOSITIONS HAVING SPECIAL FUNCTIONALITY AND A TRI-BARREL PACKAGING AND DELIVERY SYSTEM THEREFOR | KERR CORPORATION (US) | 2012-05-10 | — | — | US | claimed |
| US-20120115978-A1 | DENTAL COMPOSITION HAVING A REDOX INDICATOR AND METHOD OF USING SAME | KERR CORPORATION (US) | 2012-05-10 | — | — | US | claimed |
| EP-2450027-A2 | Dental compositions having special functionality and a tri-barrel packaging and delivery system therefor | Kerr Corporation (US) | 2012-05-09 | — | — | EP | claimed |
| EP-2450026-A2 | Dental composition having a redox indicator and method of using same | Kerr Corporation (US) | 2012-05-09 | — | — | EP | claimed |
| CN-101149383-A | Device for detecting avian influenza virus antibody and detection method | UNIV ZHEJIANG GONGSHANG (CN) | 2008-03-26 | — | — | CN | claimed |
| CN-101149384-A | Device for detecting avian influenza virus antigen and detection method | UNIV ZHEJIANG GONGSHANG (CN) | 2008-03-26 | — | — | CN | claimed |
| US-6348355-B1 | STORAGE STABLE, OXIDATION RESISTANT REDOX INDICATOR COMPRISING PHENYLENEDIAMINE, INDOPHENOL, OR BENZIDINE DERIVATIVE; DETERMINATION OF OXIDIZABLE GASES OR VAPORS | DRäGER SICHERHEITSTECHNIK GMBH (DE) | 2002-02-19 | — | — | US | claimed |