Acetic Acid

Acetic Acid

SCHEMBL31729653

CC(=O)O.C[C@]12C=CC(=O)CC1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12

nearest known ligand 0.60

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
CYP19A1 P11511 3/20 0.50
AKR1B10 O60218 2/20 0.50
AKR1B1 P15121 2/20 0.50
OR51E2 Q9H255 1/20 0.50
MAPK1 P28482 2/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
GPBAR1 Q8TDU6 4/20 0.48
G6PD P11413 4/20 0.48
LMNA P02545 3/20 0.48
CYP3A4 P08684 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
SHBG P04278 2/20 0.48
SERPINA6 P08185 2/20 0.48
HSD17B3 P37058 2/20 0.48
PMP22 Q01453 1/20 0.48
CYP2D6 P10635 1/20 0.48
TSHR P16473 1/20 0.48

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
Hydrogen Peroxide SCHEMBL27824496 0.96 CYP19A1 (0.53) CYP19A1AKR1B10AKR1B1OR51E2MAPK1
SCHEMBL12857149 0.94 CYP19A1 (0.55) CYP19A1AKR1B10AKR1B1OR51E2MAPK1
SCHEMBL1287860 0.94 CYP19A1 (0.55) CYP19A1AKR1B10AKR1B1OR51E2MAPK1
SCHEMBL2186022 0.94 CYP19A1 (0.55) CYP19A1AKR1B10AKR1B1OR51E2MAPK1
SCHEMBL1287861 0.94 CYP19A1 (0.55) CYP19A1AKR1B10AKR1B1OR51E2MAPK1
SCHEMBL9512557 0.94 CYP19A1 (0.55) CYP19A1AKR1B10AKR1B1OR51E2MAPK1
Water SCHEMBL27940020 0.93 CYP19A1 (0.54) CYP19A1AKR1B10AKR1B1OR51E2MAPK1
Sulfuric Acid SCHEMBL5532907 0.91 CYP19A1 (0.50) CYP19A1AKR1B10AKR1B1OR51E2MAPK1
SCHEMBL8676062 0.81 CYP19A1 (0.47) CYP19A1AKR1B10AKR1B1OR51E2
SCHEMBL29757161 0.80 GRIN1 (0.43) CYP19A1AKR1B10AKR1B1OR51E2MAPK1

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
US-12472188-B1 Method and composition for an improved bioavailability delivery system AMERICANA PHARMA LLC (US) 2025-11-18 US disclosed