Acetic Acid

Acetic Acid

SCHEMBL7176159

CC(=O)O.CCC1CNCCO1

nearest known ligand 0.41

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 12)

geneUniProtsupporting neighboursconfidence
ADRB2 known ✓ P07550 1/20 0.41
ADRA2C known ✓ P18825 1/20 0.38
SSTR4 known ✓ P31391 3/20 0.37
SLC6A2 P23975 12/20 0.41
SLC6A4 P31645 9/20 0.41
SLC6A3 Q01959 8/20 0.41
HTR1A P08908 1/20 0.41
HTR2A P28223 1/20 0.41
ADRA1A P35348 1/20 0.41
HTR2B P41595 1/20 0.41
CHEK1 O14757 1/20 0.33
KAT6A Q92794 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
Propionic Acid SCHEMBL28693763 0.91 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3ADRB2HTR1A
Methacrylic Acid SCHEMBL1405941 0.90 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3ADRB2HTR1A
SCHEMBL3168 0.88
SCHEMBL322796 0.88
Fluoride SCHEMBL7750151 0.88
SCHEMBL12524834 0.88
SCHEMBL7097741 0.88
Pivalate SCHEMBL5094974 0.88 SSTR4 (0.40) SLC6A2SLC6A4SLC6A3ADRB2HTR1A
Butyric Acid SCHEMBL25264905 0.86 FFAR3 (0.42) SLC6A2SLC6A4SLC6A3ADRB2HTR1A
Acrylic Acid SCHEMBL1405781 0.86 SLC6A2 (0.38) SLC6A2SLC6A4SLC6A3ADRB2HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9939352-B2 Method and system for determining the concentration of an analyte in a fluid sample LABCYTE, INC. (US) 2018-04-10 US claimed
EP-3207374-A1 METHOD AND SYSTEM FOR DETERMINING THE CONCENTRATION OF AN ANALYTE IN A FLUID SAMPLE Labcyte Inc. (US) 2017-08-23 EP claimed
WO-2016061592-A1 METHOD AND SYSTEM FOR DETERMINING THE CONCENTRATION OF AN ANALYTE IN A FLUID SAMPLE LABCYTE INC. (US) 2016-04-21 WO claimed
US-20160109336-A1 METHOD AND SYSTEM FOR DETERMINING THE CONCENTRATION OF AN ANALYTE IN A FLUID SAMPLE LABCYTE, INC. 2016-04-21 US claimed
WO-2022072560-A1 POLYPEPTIDE TERMINAL BINDERS AND USES THEREOF Encodia, Inc. (US) 2022-04-07 WO disclosed
EP-3207374-B1 METHOD AND SYSTEM FOR DETERMINING THE CONCENTRATION OF AN ANALYTE IN A FLUID SAMPLE LABCYTE INC (US) 2021-05-12 EP disclosed
US-9939352-B2 Method and system for determining the concentration of an analyte in a fluid sample LABCYTE, INC. (US) 2018-04-10 US disclosed
EP-3207374-A1 METHOD AND SYSTEM FOR DETERMINING THE CONCENTRATION OF AN ANALYTE IN A FLUID SAMPLE Labcyte Inc. (US) 2017-08-23 EP disclosed
WO-2016061592-A1 METHOD AND SYSTEM FOR DETERMINING THE CONCENTRATION OF AN ANALYTE IN A FLUID SAMPLE LABCYTE INC. (US) 2016-04-21 WO disclosed
US-20160109336-A1 METHOD AND SYSTEM FOR DETERMINING THE CONCENTRATION OF AN ANALYTE IN A FLUID SAMPLE LABCYTE, INC. 2016-04-21 US disclosed
WO-2015077660-A1 ENZYME REACTOR SYSTEM ENABLING ENHANCED ENZYMATIC DIGESTION, ANALYTE SOLUBILITY AND IMPROVED MASS SPECTROMETRIC COMPATIBILITY PERFINITY BIOSCIENCES, INC (US) 2015-05-28 WO disclosed
EP-1341813-A1 USE OF L-CARNITINE AS STABILIZING AGENT OF PROTEINS Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 2003-09-10 EP disclosed
US-5095005-A For foods MORINAGA MILK INDUSTRY CO., LTD. (JP) 1992-03-10 US disclosed
EP-0458903-A1 SOLUBLE ANALOGS OF THROMBOMODULIN CODON (US) 1991-12-04 EP disclosed
EP-0391407-A1 Polypeptide and antibacterial preparations containing the same MORINAGA MILK INDUSTRY CO., LTD. (JP) 1990-10-10 EP disclosed
US-4956281-A Polypeptides, codes, binding, genetic engineering BIOGEN, INC. (US) 1990-09-11 US disclosed
WO-1990010081-A1 SOLUBLE ANALOGS OF THROMBOMODULIN CODON (US) 1990-09-07 WO disclosed
EP-0315683-A4 DNA SEQUENCES, RECOMBINANT DNA MOLECULES AND PROCESSES FOR PRODUCING LYMPHOCYTE FUNCTION ASSOCIATED ANTIGEN-3. BIOGEN NV (NL) 1990-02-05 EP disclosed
EP-0315683-A1 DNA SEQUENCES, RECOMBINANT DNA MOLECULES AND PROCESSES FOR PRODUCING LYMPHOCYTE FUNCTION ASSOCIATED ANTIGEN-3 BIOGEN, INC. (US) 1989-05-17 EP disclosed
WO-1988009820-A1 DNA SEQUENCES, RECOMBINANT DNA MOLECULES AND PROCESSES FOR PRODUCING LYMPHOCYTE FUNCTION ASSOCIATED ANTIGEN-3 BIOGEN N.V. (AN) 1988-12-15 WO disclosed