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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.89 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Naphthalene SCHEMBL28102503 | 0.98 | TDP1 (0.86) | TDP1CYP1A2ATMSIRT5L3MBTL1 | |
| Acetone SCHEMBL28007682 | 0.96 | TDP1 (0.89) | TDP1CYP1A2ATMSIRT5L3MBTL1 | |
| Methyl Alcohol SCHEMBL7855695 | 0.94 | TDP1 (0.92) | TDP1CYP1A2ATMSIRT5L3MBTL1 | |
| SCHEMBL27710793 | 0.94 | TDP1 (1.00) | TDP1CYP1A2ATML3MBTL1AKR1B1 | |
| SCHEMBL35925 | 0.94 | TDP1 (1.00) | TDP1CYP1A2ATML3MBTL1AKR1B1 | |
| SCHEMBL29607554 | 0.94 | TDP1 (1.00) | TDP1CYP1A2ATML3MBTL1AKR1B1 | |
| SCHEMBL11437701 | 0.92 | TDP1 (0.96) | TDP1CYP1A2ATML3MBTL1AKR1B1 | |
| Ammonia Solution, Strong SCHEMBL2688886 | 0.92 | TDP1 (0.96) | TDP1CYP1A2ATML3MBTL1AKR1B1 | |
| SCHEMBL3955514 | 0.92 | TDP1 (0.96) | TDP1CYP1A2ATML3MBTL1AKR1B1 | |
| Ammonia Solution, Strong SCHEMBL21246668 | 0.92 | TDP1 (0.96) | TDP1CYP1A2ATML3MBTL1AKR1B1 |
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 122 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104865248-B | A kind of preparation method for the recombinant silkworm acetylcholinesterase for being used to detect pesticide residue | 华南农业大学 | 2018-05-01 | — | — | CN | claimed |
| CN-104865248-A | Method for preparing recombinant bombyx mori acetylcholinesterase for detecting pesticide residue | UNIV SOUTH CHINA AGRICULT | 2015-08-26 | — | — | CN | claimed |
| CN-104569039-A | Method for detecting organophosphorus pesticide residues by adopting enzyme reactor | SUZHOU GUOHUAN ENV DETECTION CO LTD | 2015-04-29 | — | — | CN | claimed |
| CN-203502356-U | Test strip for quickly detecting pesticide residues in fruits and vegetables | UNIV JILIANG CHINA | 2014-03-26 | — | — | CN | claimed |
| CN-102636612-B | Method for analyzing active component in harmel grass | UNIV SHANGHAI OF T C M | 2013-12-11 | — | — | CN | claimed |
| CN-111867626-A | Methods and compositions for treating amyloid deposition diseases | 纽约哥伦比亚大学理事会 | 2020-10-30 | — | — | CN | disclosed |
| CN-110475622-A | With the method and its enzymatic compositions of the enzymatic compositions dissolution municipal solid waste comprising protease | NOVOZYMES AS | 2019-11-19 | — | — | CN | disclosed |
| CN-105838698-B | Polypeptide with cellobiohydrolase activity and the polynucleotides for encoding the polypeptide | 诺维信公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-105886485-B | β-glucosyl enzym variant and its coded polynucleotide | 诺维信股份有限公司 | 2019-09-24 | — | — | CN | disclosed |
| CN-110079558-A | With the method for 61 polypeptide pre-treating cellulosic material of family | 诺维信股份有限公司 | 2019-08-02 | — | — | CN | disclosed |
| CN-104694517-B | Polypeptide with xylanase activity and the polynucleotides for encoding the polypeptide | 诺维信股份有限公司 | 2019-06-28 | — | — | CN | disclosed |
| CN-106167796-B | Composition for saccharified cellulosic material | 诺维信股份有限公司 | 2019-06-04 | — | — | CN | disclosed |
| CN-103068976-A | Polypeptides having cellobiohydrolase activity and polynucleotides encoding same | NOVOZYMES INC | 2013-04-24 | — | — | CN | disclosed |
| CN-102947442-A | Compositions for saccharifying cellulosic material | NOVOZYMES INC | 2013-02-27 | — | — | CN | disclosed |
| CN-102918151-A | Cellobiohydrolase variants and polynucleotides encoding same | NOVOZYMES INC | 2013-02-06 | — | — | CN | disclosed |
| CN-101909461-A | Polypeptides having acetylxylan esterase activity and polynucleotides encoding same | NOVOZYMES AS | 2010-12-08 | — | — | CN | disclosed |
| US-5498729-A | MIXED ANHYDRIDES | DOMB ABRAHAM J (IL) | 1996-03-12 | — | — | US | disclosed |
| EP-0510080-A4 | PRODRUG ANHYDRIDES OF ASPRIN, INDOMETHACIN AND IBUPROFEN, THEIR PREPARATION, COMPOSITIONS, AND ANTI-INFLAMMATORY METHOD OF USE | — | 1992-12-02 | — | — | EP | disclosed |
| EP-0510080-A1 | PRODRUG ANHYDRIDES OF ASPRIN, INDOMETHACIN AND IBUPROFEN, THEIR PREPARATION, COMPOSITIONS, AND ANTI-INFLAMMATORY METHOD OF USE | NOVA PHARMACEUTICAL CORPORATION (US) | 1992-10-28 | — | — | EP | disclosed |
| WO-1991009831-A1 | PRODRUG ANHYDRIDES OF ASPRIN, INDOMETHACIN AND IBUPROFEN, THEIR PREPARATION, COMPOSITIONS, AND ANTI-INFLAMMATORY METHOD OF USE | NOVA PHARMACEUTICAL CORPORATION (US) | 1991-07-11 | — | — | WO | disclosed |