Acetic Acid

Acetic Acid

SCHEMBL973954

C=C.CC(=O)O.OCCO

nearest known ligand 0.54

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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
FFAR3 O14843 2/20 0.54
LCK P06239 1/20 0.54
FYN P06241 1/20 0.54
TSHR P16473 2/20 0.39
LMNA P02545 3/20 0.36
ALDH1A1 P00352 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
SLC15A2 Q16348 1/20 0.35
CAMK2A Q9UQM7 1/20 0.35
TRPA1 O75762 1/20 0.33
THPO P40225 1/20 0.33
TGFBR1 P36897 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
OR51E2 Q9H255 1/20 0.32
CA1 P00915 1/20 0.31
ALOX15 P16050 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31

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 SCHEMBL21961942 1.00 FFAR3 (0.54) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL28070973 1.00 FFAR3 (0.54) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL2959365 0.96 FFAR3 (0.50) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL25333160 0.92 FFAR3 (0.54) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL1879030 0.92 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL8888237 0.92 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL139024 0.92 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL17909908 0.92 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL2516097 0.92 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA
Acetic Acid SCHEMBL1578192 0.92 FFAR3 (0.64) FFAR3LCKFYNTSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546455-B2 Expanded polystyrene solubilization method ESKA (FR) 2013-10-01 US disclosed
CN-101699553-B Display device, its driving method, and electronic equipment SEMICONDUCTOR ENERGY LAB 2012-03-21 CN disclosed
US-20110021647-A1 Expanded polystyrene solubilization method ESKA (FR) 2011-01-27 US disclosed
US-4626453-A Coating compositions and method for improving the properties of coated substrates COATINGS FOR INDUSTRY, INC. (US) 1986-12-02 US disclosed