Acetic Acid

Acetic Acid

SCHEMBL27658337

CC(=O)O.N[O]

nearest known ligand 0.00

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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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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.

Compoundsimilaritytop predictedshared targets
Acetic Acid SCHEMBL7897388 0.89 FFAR3 (0.78)
Acetic Acid SCHEMBL28186565 0.89 FFAR3 (0.78)
Acetic Acid SCHEMBL133659 0.89
Acetic Acid SCHEMBL6049138 0.89 FFAR3 (0.78)
Acetic Acid SCHEMBL21753924 0.89 FFAR3 (0.78)
Acetic Acid SCHEMBL11280978 0.89 FFAR3 (0.78)
Acetic Acid SCHEMBL895797 0.89
Acetic Acid SCHEMBL584739 0.89
Acetic Acid SCHEMBL1331810 0.88
Acetic Acid SCHEMBL41073 0.88 FFAR3 (1.00)

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109846871-B Application of aminoxyacetic acid in preparing medicine for treating liver cancer 重庆医科大学 2021-04-02 CN disclosed
CN-111903520-A Method for regenerating plant by using isolated microspore embryoid of ginseng 梁江 2020-11-10 CN disclosed
CN-105452202-B Radiolabelling method 通用电气健康护理有限公司 2018-12-28 CN disclosed
CN-107205969-A Pharmaceutical composition for treating diabetes 韩德株式会社 2017-09-26 CN disclosed
CN-107108536-A Biguanide compound and application thereof 伊谬诺米特医疗有限公司 2017-08-29 CN disclosed
CN-106714793-A Succinate dehydrogenase inhibitors (sdhi's) 医药研究委员会 2017-05-24 CN disclosed
CN-105452202-A Radiolabelling method GE HEALTHCARE LTD 2016-03-30 CN disclosed
CN-105063072-A Aldolases, nucleic acids encoding them and methods for making and using them VERENIUM CORP 2015-11-18 CN disclosed
CN-104984372-A RADIO CONJUGATION METHOD GE HEALTHCARE LTD 2015-10-21 CN disclosed
CN-103269725-B Radio conjugation method GE HEALTHCARE LTD. (GB) 2015-09-23 CN disclosed
CN-102690833-B Zymohexase, encode their nucleic acid and preparation and their method of use BASF ENZYMES LLC (US) 2015-09-09 CN disclosed
CN-101437954-B The nucleic acid of zymohexase and coding zymohexase and their preparation and application CARGILL, INC. (US) 2015-09-09 CN disclosed
CN-103269725-A Radio conjugation method GE HEALTHCARE LTD 2013-08-28 CN disclosed
CN-101443446-B Aldolases, nucleic acids encoding them, and methods of making and using them VERENIUM CORP 2013-08-21 CN disclosed
CN-1798567-A Anti-stress agent SUNTORY LTD (JP) 2006-07-05 CN disclosed