Acetic Acid

Acetic Acid

SCHEMBL9837353

CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CNC

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 3/20 0.46
ALDH1A1 P00352 4/20 0.43
CA2 P00918 2/20 0.43
KDM4E B2RXH2 1/20 0.43
PTGS1 P23219 1/20 0.43
MMP12 P39900 1/20 0.43
TSHR P16473 2/20 0.42
THPO P40225 1/20 0.42
NFKB1 P19838 1/20 0.40
CA1 P00915 3/20 0.39
ALOX15 P16050 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
CA9 Q16790 1/20 0.36
LDHA P00338 1/20 0.36
SRR Q9GZT4 1/20 0.36
SLC15A2 Q16348 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 SCHEMBL11564713 1.00 FFAR3 (0.70) FFAR3LCKFYNLMNAALDH1A1
Acetic Acid SCHEMBL21779 1.00
Acetic Acid SCHEMBL11564711 1.00 FFAR3 (0.70) FFAR3LCKFYNLMNAALDH1A1
Acetic Acid SCHEMBL5567780 1.00 FFAR3 (0.70) FFAR3LCKFYNLMNAALDH1A1
Acetic Acid SCHEMBL5567779 1.00 FFAR3 (0.70) FFAR3LCKFYNLMNAALDH1A1
Acetic Acid SCHEMBL4413742 0.95
Acetic Acid SCHEMBL3788325 0.95
Acetic Acid SCHEMBL27427778 0.86
Acetic Acid SCHEMBL28306126 0.84 FFAR3 (0.50) FFAR3LCKFYNLMNAALDH1A1
Acetic Acid SCHEMBL7710929 0.84 FFAR3 (0.50) FFAR3LCKFYNALDH1A1TSHR

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
JP-3104190-A None JP disclosed
JP-H03104190-A MULTI-LAYER WIRING BOARD AND MANUFACTURE THEREOF TOSHIBA CORP 1991-05-01 JP disclosed