Acetic Acid

Acetic Acid

SCHEMBL7572365

CC(=O)O.O.O.O.O.O.O.O.O.O.[Ca+2].[Cl-].[Cl-]

nearest known ligand 0.70

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.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 2/20 0.70
LCK P06239 1/20 0.70
FYN P06241 1/20 0.70
LMNA P02545 5/20 0.46
TSHR P16473 2/20 0.42
THPO P40225 1/20 0.42
CA1 P00915 3/20 0.39
ALOX15 P16050 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
CA2 P00918 2/20 0.36
CA9 Q16790 1/20 0.36
ALDH1A1 P00352 5/20 0.33
SLC15A2 Q16348 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
PTGS1 P23219 1/20 0.33
MMP12 P39900 1/20 0.33
CA4 P22748 1/20 0.33
APEX1 P27695 1/20 0.32

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 SCHEMBL27978800 0.95
Acetic Acid SCHEMBL28088830 0.95
Acetic Acid SCHEMBL5390257 0.95 FFAR3 (0.78) FFAR3LCKFYNLMNATSHR
Acetic Acid SCHEMBL29264072 0.95
Acetic Acid SCHEMBL9329106 0.90
Acetic Acid SCHEMBL4124082 0.89
Acetic Acid SCHEMBL9267268 0.89 FFAR3 (0.88) FFAR3LCKFYNLMNATSHR
Acetic Acid SCHEMBL2282261 0.89 FFAR3 (0.88) FFAR3LCKFYNLMNATSHR
Acetic Acid SCHEMBL5573359 0.89 FFAR3 (0.88) FFAR3LCKFYNLMNATSHR
Acetic Acid SCHEMBL51762 0.89

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020045027-A1 Anti-fog resin sheet, anti-fog agent and method article DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-04-18 US disclosed
EP-1184408-A2 Anti-fog resin sheet, anti-fog agent and molded article DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-03-06 EP disclosed