Acetic Acid

Acetic Acid

SCHEMBL328882

CC(=O)[O-].CC(=O)[O-].CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.48

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
TSHR P16473 2/20 0.48
CYP1A2 P05177 2/20 0.48
ALDH1A1 P00352 2/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
HIF1A Q16665 1/20 0.44
CES2 O00748 4/20 0.41
CES1 P23141 4/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
POLB P06746 2/20 0.39
ALPL P05186 1/20 0.39
ALPG P10696 1/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37

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 SCHEMBL133341 1.00 TSHR (0.48) TSHRCYP1A2ALDH1A1CYP2D6CYP2C19
Acetic Acid SCHEMBL27993794 0.98 TSHR (0.47) TSHRCYP1A2ALDH1A1CYP2D6CYP2C19
Acetic Acid SCHEMBL10484555 0.98 CYP1A2 (0.47) TSHRCYP1A2ALDH1A1CYP2D6CYP2C19
Acetic Acid SCHEMBL9467718 0.98 TSHR (0.47) TSHRCYP1A2ALDH1A1CYP2D6CYP2C19
Acetic Acid SCHEMBL328881 0.98 TSHR (0.47) TSHRCYP1A2ALDH1A1CYP2D6CYP2C19
Acetic Acid SCHEMBL10422777 0.96 TSHR (0.46) TSHRCYP1A2ALDH1A1CYP2D6CYP2C19
Acetic Acid SCHEMBL1651995 0.96 TSHR (0.46) TSHRCYP1A2ALDH1A1CYP2D6CYP2C19
Acetic Acid SCHEMBL10580400 0.96 TSHR (0.46) TSHRCYP1A2ALDH1A1CYP2D6CYP2C19
Bicarbonate SCHEMBL1144353 0.94 CYP1A2 (0.50) TSHRCYP1A2ALDH1A1CYP2D6CYP2C19
Bicarbonate SCHEMBL11663344 0.94 CYP1A2 (0.50) TSHRCYP1A2ALDH1A1CYP2D6CYP2C19

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 377 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0458502-B1 Latent catalysts, cure-inhibited epoxy resin compositions and laminates prepared therefrom DOW GLOBAL TECHNOLOGIES INC (US) 2003-06-18 EP claimed
US-5169473-A Complex of an onium, arsenic or amine compound and boric acid; advanced polyepoxides; storage stability THE DOW CHEMICAL COMPANY (US) 1992-12-08 US claimed
EP-0458502-A2 Latent catalysts, cure-inhibited epoxy resin compositions and laminates prepared therefrom THE DOW CHEMICAL COMPANY (US) 1991-11-27 EP claimed
US-4925901-A STORAGE STAABILITY, ONIUM ION CATALYST THE DOW CHEMICAL COMPANY (US) 1990-05-15 US claimed
EP-0116594-B1 A PROCESS FOR PARTIALLY HYDROLYZING EPOXY RESINS IN THE ABSENCE OF AN ORGANIC SOLVENT AND IN THE PRESENCE OF A DICARBOXYLIC ACID AND A PHOSPHONIUM COMPOUND THE DOW CHEMICAL COMPANY (US) 1989-01-25 EP claimed
US-4783363-A ELECTRICAL LAMINATES THE DOW CHEMICAL COMPANY (US) 1988-11-08 US claimed
US-4604317-A ELECTRICAL LAMINATES THE DOW CHEMICAL COMPANY (US) 1986-08-05 US claimed
US-4596861-A Diglycidyl ether of bisphenol A, epoxy equivalent of 3000 to 3900 THE DOW CHEMICAL COMPANY (US) 1986-06-24 US claimed
EP-0116594-A4 A PROCESS FOR PARTIALLY HYDROLYZING EPOXY RESINS IN THE ABSENCE OF AN ORGANIC SOLVENT AND IN THE PRESENCE OF A DICARBOXYLIC ACID AND A PHOSPHONIUM COMPOUND. DOW CHEMICAL CO (US) 1985-02-28 EP claimed
US-4496709-A REACTING AN EPOXIDE WITH A DIHYDRIC PHENOL OR A THIOPHENOLIC COMPOUND THE DOW CHEMICAL COMPANY (US) 1985-01-29 US claimed
EP-0116594-A1 A PROCESS FOR PARTIALLY HYDROLYZING EPOXY RESINS IN THE ABSENCE OF AN ORGANIC SOLVENT AND IN THE PRESENCE OF A DICARBOXYLIC ACID AND A PHOSPHONIUM COMPOUND. DOW CHEMICAL CO (US) 1984-08-29 EP claimed
WO-1984000766-A1 A PROCESS FOR HYDROLYZING EPOXY RESINS IN THE ABSENCE OF A POLYHYDRIC PHENOL AND AN ORGANIC SOLVENT AND IN THE PRESENCE OF A DICARBOXYLIC ACID AND A PHOSPHONIUM COMPOUND DOW CHEMICAL CO (US) 1984-03-01 WO claimed
US-4404335-A Hydrolyzing epoxy resins in absence of solvent and in presence of oxalic acid and a phosphonium compound THE DOW CHEMICAL COMPANY (US) 1983-09-13 US claimed
EP-0065564-A4 METHOD FOR PREPARING HIGH MOLECULAR WEIGHT EPOXY RESINS CONTAINING HYDROLYZED GLYCIDYL GROUPS. DOW CHEMICAL CO (US) 1983-03-29 EP claimed
EP-0065564-A1 METHOD FOR PREPARING HIGH MOLECULAR WEIGHT EPOXY RESINS CONTAINING HYDROLYZED GLYCIDYL GROUPS. DOW CHEMICAL CO (US) 1982-12-01 EP claimed
US-4340713-A IN THE PRESENCE OF HYDROLYSIS CATALYST THE DOW CHEMICAL COMPANY (US) 1982-07-20 US claimed
WO-1982001878-A1 METHOD FOR PREPARING HIGH MOLECULAR WEIGHT EPOXY RESINS CONTAINING HYDROLYZED GLYCIDYL GROUPS DOW CHEMICAL CO (US) 1982-06-10 WO claimed
US-4322456-A BY IN SITU POLYMERIZATION OF LOW MOLECULAR WEIGHT RESIN AN A PHENOLIC HYDROXY COMPOUND THE DOW CHEMICAL COMPANY (US) 1982-03-30 US claimed
JP-4211402-A None JP disclosed
US-3931109-A PROCESS FOR COATING SUBSTRATES WITH HIGH MOLECULAR WEIGHT EPOXY RESINS THE DOW CHEMICAL COMPANY (US) 1976-01-06 US disclosed