Acetic Acid

Acetic Acid

SCHEMBL3337776

CC(=O)O.CCO.N#CC(=O)O

nearest known ligand 0.41

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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.

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 3/20 0.41
LCK P06239 1/20 0.41
FYN P06241 1/20 0.41
ALDH1A1 P00352 4/20 0.35
TSHR P16473 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
THPO P40225 1/20 0.33
MCL1 Q07820 2/20 0.32
CES1 P23141 1/20 0.31
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30

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.

Compoundsimilaritytop predictedshared targets
Acetic Acid SCHEMBL11608458 1.00 FFAR3 (0.41) FFAR3LCKFYNALDH1A1TSHR
Acetic Acid SCHEMBL11232036 0.97 FFAR3 (0.39) FFAR3LCKFYNALDH1A1TSHR
Acetic Acid SCHEMBL29036895 0.97 FFAR3 (0.39) FFAR3LCKFYNALDH1A1TSHR
Acetic Acid SCHEMBL28409285 0.97 FFAR3 (0.39) FFAR3LCKFYNALDH1A1TSHR
Acetic Acid SCHEMBL9691028 0.97 FFAR3 (0.39) FFAR3LCKFYNALDH1A1TSHR
Acetic Acid SCHEMBL6268864 0.88 CHRM2 (0.38) FFAR3LCKFYN
Acetic Acid SCHEMBL30830 0.87 FFAR3 (0.54) FFAR3LCKFYNTSHRTDP1
Acetic Acid SCHEMBL8437478 0.87
Acetic Acid SCHEMBL7849408 0.87 FFAR3 (0.54) FFAR3LCKFYNTSHRTDP1
Acetic Acid SCHEMBL3925485 0.87 FFAR3 (0.54) FFAR3LCKFYNTSHRTDP1

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 82 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4240920-A A SURFACTANT, A PEROXY BLEACH AND A PORPHINE BLEACH THE PROCTER & GAMBLE COMPANY (US) 1980-12-23 US claimed
US-3954679-A Viscosity reduction of aqueous alpha-olefin sulfonate detergent composition COLGATE-PALMOLIVE COMPANY (US) 1976-05-04 US claimed
CN-113167017-B Method for treating fabrics 罗地亚经营管理公司 2024-02-27 CN disclosed
EP-4323487-A1 COMPOSITION Unilever IP Holdings B.V. (NL) 2024-02-21 EP disclosed
CN-117083428-A Method for treating fabrics 法国特种经营公司 2023-11-17 CN disclosed
WO-2023057532-A2 COMPOSITION UNILEVER IP HOLDINGS B.V. (NL) 2023-04-13 WO disclosed
WO-2023057530-A2 COMPOSITION UNILEVER IP HOLDINGS B.V. (NL) 2023-04-13 WO disclosed
CN-113167017-A Method for treating a fabric 罗地亚经营管理公司 2021-07-23 CN disclosed
US-10067118-B2 Single molecule filter and single molecule electrograph, and process for making and using same NATIONAL INSTITUTE OF STANDARDS AND TECHNOLOGY (US) 2018-09-04 US disclosed
US-9562292-B2 Photoactive article, process for making, and use of same THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF COMMERCE (US) 2017-02-07 US disclosed
US-20160033451-A1 SINGLE MOLECULE FILTER AND SINGLE MOLECULE ELECTROGRAPH, AND PROCESS FOR MAKING AND USING SAME GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF COMMERCE, THE NATIONAL INSTITUTE OF STANDARDS AND TECHNOLOGY 2016-02-04 US disclosed
US-4007124-A Process for preparing a silicate-pyrophosphate detergent composition THE PROCTER & GAMBLE COMPANY (US) 1977-02-08 US disclosed
US-3997692-A Process of coating calcium sulfate dihydrate detergent filler particles LEVER BROTHERS COMPANY (US) 1976-12-14 US disclosed
US-3986986-A DETERGENTS LEVER BROTHERS COMPANY (US) 1976-10-19 US disclosed
US-3954679-A Viscosity reduction of aqueous alpha-olefin sulfonate detergent composition COLGATE-PALMOLIVE COMPANY (US) 1976-05-04 US disclosed
US-3954649-A Detergent compositions containing coated particulate calcium sulfate dihydrate LEVER BROTHERS COMPANY (US) 1976-05-04 US disclosed
US-3953382-A N-ALKANOL ALKANE-AMIDES, TERTIARY AMINE OXIDES, ALKYL SULFOXIDES LEVER BROTHERS COMPANY (US) 1976-04-27 US disclosed
US-3940433-A SURFACTANTS, DETERGENTS LEVER BROTHERS COMPANY (US) 1976-02-24 US disclosed
US-3939100-A Combination alkali metal pyrophosphate-alkaline earth metal pyrophosphate detergent builder THE PROCTER & GAMBLE COMPANY (US) 1976-02-17 US disclosed
US-3932316-A PHOSPHATE-FREE THE PROCTER & GAMBLE COMPANY (US) 1976-01-13 US disclosed