Acetic Acid

Acetic Acid

SCHEMBL449429

CC(=O)O.Cl.[CaH2].[NaH]

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 SCHEMBL28942881 0.95 FFAR3 (0.78)
Acetic Acid SCHEMBL28364497 0.95 FFAR3 (0.78)
Acetic Acid SCHEMBL5420334 0.95
Acetic Acid SCHEMBL10955035 0.95
Acetic Acid SCHEMBL10996839 0.95
Acetic Acid SCHEMBL197557 0.95
Acetic Acid SCHEMBL3630519 0.95
Acetic Acid SCHEMBL11187676 0.95 FFAR3 (0.78)
Acetic Acid SCHEMBL19285650 0.95 FFAR3 (0.78)
Acetic Acid SCHEMBL1110404 0.95 FFAR3 (0.78)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107846944-B Meat modifier 味之素株式会社 2021-05-14 CN disclosed
CN-108783430-A A kind of preparation method of rose ferment 河南工业大学 2018-11-13 CN disclosed
CN-107043760-A A kind of kallidinogenase and its preparation technology 临沂新程金锣肉制品集团有限公司 2017-08-15 CN disclosed
US-8445240-B2 Termite enzymes and uses thereof for in vitro conversion of lignin-containing materials to fermentable products UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2013-05-21 US disclosed
US-20120064580-A1 TERMITE ENZYMES AND USES THEREOF FOR IN VITRO CONVERSION OF LIGNIN-CONTAINING MATERIALS TO FERMENTABLE PRODUCTS UNITED STATES DEPARTMENT OF ENERGY 2012-03-15 US disclosed
WO-2010117843-A2 TERMITE ENZYMES AND USES THEREOF FOR IN VITRO CONVERSION OF LIGNIN-CONTAINING MATERIALS TO FERMENTABLE PRODUCTS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2010-10-14 WO disclosed
US-7060474-B1 Carbohydrate oxidase and use thereof in baking NOVOZYMES A/S (DK) 2006-06-13 US disclosed