Acetic Acid

Acetic Acid

SCHEMBL22472233

CC(=O)O.Cl.O=C1C=CC(=O)N1

nearest known ligand 0.61

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 8)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.61
GSK3B P49841 1/20 0.61
CCR6 P51684 1/20 0.61
FFAR3 O14843 1/20 0.39
LCK P06239 1/20 0.39
FYN P06241 1/20 0.39
MIF P14174 1/20 0.31
LDHA P00338 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 SCHEMBL29870582 0.97 GSK3A (0.65) GSK3AGSK3BCCR6FFAR3LCK
Acetic Acid SCHEMBL208214 0.97 GSK3A (0.65) GSK3AGSK3BCCR6FFAR3LCK
Acetic Acid SCHEMBL28467168 0.90 GSK3A (0.55) GSK3AGSK3BCCR6FFAR3LCK
Acetic Acid SCHEMBL28460657 0.87 GSK3A (0.52) GSK3AGSK3BCCR6FFAR3LCK
Acetic Acid SCHEMBL20637067 0.87 GSK3A (0.52) GSK3AGSK3BCCR6FFAR3LCK
Methacrylic Acid SCHEMBL28414138 0.82 GSK3A (0.52) GSK3AGSK3BCCR6
Methacrylic Acid SCHEMBL482701 0.82 GSK3A (0.52) GSK3AGSK3BCCR6
Methacrylic Acid SCHEMBL9719968 0.82 GSK3A (0.52) GSK3AGSK3BCCR6
Acetic Acid SCHEMBL28462827 0.82 GSK3A (0.46) GSK3AGSK3BCCR6
Acetic Acid SCHEMBL28899322 0.82 GSK3A (0.46) GSK3AGSK3BCCR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020196829-A1 RESIN MATERIAL AND MULTILAYER PRINTED WIRING BOARD 積水化学工業株式会社 2020-10-01 WO disclosed