Acetic Acid

Acetic Acid

SCHEMBL6855692

CC(=O)O.O=[N+]([O-])[O-].[Na+]

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

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 SCHEMBL27858562 0.96 FFAR3 (0.50)
Acetic Acid SCHEMBL11408952 0.96 FFAR3 (0.50)
Acetic Acid SCHEMBL11420713 0.96 FFAR3 (0.50)
Acetic Acid SCHEMBL7517423 0.92
Acetic Acid SCHEMBL10595188 0.92 FFAR3 (0.54)
Acetic Acid SCHEMBL12544195 0.92 FFAR3 (0.54)
Acetic Acid SCHEMBL28041226 0.92 FFAR3 (0.54)
Acetic Acid SCHEMBL28610104 0.92
Acetic Acid SCHEMBL6841023 0.92 FFAR3 (0.54)
Acetic Acid SCHEMBL28795718 0.92 FFAR3 (0.54)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113373072-B Heterotrophic nitrification aerobic denitrification fungus strain and separation method and application thereof 自然资源部第三海洋研究所 2023-06-09 CN disclosed
CN-113373072-A Heterotrophic nitrification aerobic denitrification fungus strain and separation method and application thereof 自然资源部第三海洋研究所 2021-09-10 CN disclosed
CN-211987148-U Fractionating device for mixed acid of phosphoric acid, acetic acid and nitric acid 西安九环科技有限公司 2020-11-24 CN disclosed
CN-111018268-A Resin coupling denitrification method 南京大学 2020-04-17 CN disclosed
CN-108218855-A A kind of novel tubulin inhibitor and its application in antitumor drug 桑文军 2018-06-29 CN disclosed
CN-104271532-B Gypsum Fibrosum dispersant TOHO CHEMICAL INDUSTRY CO.,LTD. (JP) 2016-11-30 CN disclosed
CN-104271531-A Gypsum dispersant TOHO CHEM IND CO LTD 2015-01-07 CN disclosed
CN-104271532-A Gypsum dispersant TOHO CHEM IND CO LTD 2015-01-07 CN disclosed
US-6787192-B2 Process for producing part made of magnesium and/or magnesium alloy OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2004-09-07 US disclosed
US-20030145908-A1 Process for producing part made of magnesium and/or magnesium alloy OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2003-08-07 US disclosed
EP-1277853-A1 PROCESS FOR PRODUCING PART MADE OF MAGNESIUM AND/OR MAGNESIUM ALLOY OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 2003-01-22 EP disclosed