Acetic Acid

Acetic Acid

SCHEMBL3683091

CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.O.O.O.O.O.[Ce+3]

nearest known ligand 0.80

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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 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.80
CA4 P22748 3/20 0.54
LMNA P02545 2/20 0.46
TSHR P16473 2/20 0.42
FFAR3 O14843 2/20 0.42
THPO P40225 1/20 0.42
LCK P06239 1/20 0.42
FYN P06241 1/20 0.42
ALOX15 P16050 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
FAHD1 Q6P587 1/20 0.39
CES1 P23141 1/20 0.35
ALDH1A1 P00352 2/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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 SCHEMBL31454250 1.00 CA1 (0.80) CA1CA4LMNATSHRFFAR3
Acetic Acid SCHEMBL26101431 1.00 CA1 (0.80) CA1CA4LMNATSHRFFAR3
Acetic Acid SCHEMBL231131 1.00 CA1 (0.80) CA1CA4LMNATSHRFFAR3
Acetic Acid SCHEMBL14245773 1.00 CA1 (0.80) CA1CA4LMNATSHRFFAR3
Acetic Acid SCHEMBL721668 1.00 CA1 (0.80) CA1CA4LMNATSHRFFAR3
Acetic Acid SCHEMBL25334487 1.00 CA1 (0.80) CA1CA4LMNATSHRFFAR3
Acetic Acid SCHEMBL2176610 1.00 CA1 (0.80) CA1CA4LMNATSHRFFAR3
Acetic Acid SCHEMBL34888 0.95 CA1 (0.89) CA1CA4LMNATSHRFFAR3
Acetic Acid SCHEMBL25170206 0.90 CA1 (0.80) CA1CA4LMNATSHRFFAR3
Acetic Acid SCHEMBL21848043 0.90 CA1 (0.80) CA1CA4LMNATSHRFFAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119143194-A Preparation method of ultra-high nickel anode material 广西银亿高新技术研发有限公司 2024-12-17 CN claimed
CN-114628663-B Cerium doped ternary cathode material and preparation method thereof 华鼎国联四川电池材料有限公司 2024-04-09 CN claimed
CN-114628663-A Cerium-doped ternary cathode material and preparation method thereof 华鼎国联四川电池材料有限公司 2022-06-14 CN claimed
CN-119143194-A Preparation method of ultra-high nickel anode material 广西银亿高新技术研发有限公司 2024-12-17 CN disclosed
CN-114628663-B Cerium doped ternary cathode material and preparation method thereof 华鼎国联四川电池材料有限公司 2024-04-09 CN disclosed
CN-113926455-B Preparation method of bimetallic nanoparticle fiber catalyst 河南科技大学 2024-01-23 CN disclosed
CN-114628663-A Cerium-doped ternary cathode material and preparation method thereof 华鼎国联四川电池材料有限公司 2022-06-14 CN disclosed
CN-113926455-A Preparation method of bimetallic nanoparticle fiber catalyst 河南科技大学 2022-01-14 CN disclosed
US-7709681-B2 Process for the production of trimellitic acid POLYNT S.P.A. (IT) 2010-05-04 US disclosed
US-20090043124-A1 Avoiding high concentrations of pseudocumene at the beginning of the oxidation and limiting the degree of oxidation by gradually and simultaneously feeding pseudocumene and air or oxygen into an acetic acid/catalyst solution; catalyst consistency; by-product inhibition; industrial scale POLYNT S.P.A. (IT) 2009-02-12 US disclosed
EP-1728778-B1 Process for the production of trimellitic acid POLYNT S P A (IT) 2009-01-28 EP disclosed
EP-1728778-A1 Process for the production of trimellitic acid Lonza S.p.A. (IT) 2006-12-06 EP disclosed
WO-2006119939-A1 PROCESS FOR THE PRODUCTION OF TRIMELLITIC ACID POLYNT SPA (IT) 2006-11-16 WO disclosed