Acetic Acid

Acetic Acid

SCHEMBL5567780

CC(=O)O.CNC.CNC.CNC.CNC.CNC.CNC.CNC.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 SCHEMBL9837353 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 120 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7138518-B1 Liquid chromatographic separation of polynucleotides TRANSGENOMIC, INC. (US) 2006-11-21 US claimed
EP-1299166-A4 POLYNUCLEOTIDE SEPARATIONS ON POLYMERIC SEPARATION MEDIA TRANSGENOMIC INC (US) 2003-07-09 EP claimed
US-6576133-B2 Rna mixture TRANSGENOMIC, INC 2003-06-10 US claimed
US-20030102260-A1 Non-polar media for polynucloetide separations TRANSGENOMIC, INC. (US) 2003-06-05 US claimed
US-20030082562-A1 Maxam gilbert g/a sequence analysis by DHPLC HORNBY DAVID P (GB) 2003-05-01 US claimed
US-20030075503-A1 Non-polar media for polynucleotide separations GJERDE DOUGLAS T (US) 2003-04-24 US claimed
EP-1299166-A1 POLYNUCLEOTIDE SEPARATIONS ON POLYMERIC SEPARATION MEDIA TRANSGENOMIC, Inc. (US) 2003-04-09 EP claimed
US-6524480-B2 Chromatography TRANSGENOMIC, INC. 2003-02-25 US claimed
EP-1274837-A2 APPARATUS AND METHOD FOR SEPARATING AND PURIFYING POLYNUCLEOTIDES TRANSGENOMIC, Inc. (US) 2003-01-15 EP claimed
US-6503397-B2 Applying a mixture of polynucleotides having up to 1500 base pairs to a separation medium, the separation surfaces of medium is coated with hydrocarbon or non-polar hydrocarbon substituted polymer, eluting the mixture of TRANSGENOMIC, INC. 2003-01-07 US claimed
US-20010030156-A1 Polynucleotide separations on polymeric separation ADS BIOTEC INC. 2001-10-18 US claimed
US-20010023848-A1 Non-polar media for polynucleotide separations ADS BIOTEC INC. 2001-09-27 US claimed
WO-2001066216-A1 METHOD AND SYSTEM FOR RNA ANALYSIS BY MATCHED ION POLYNUCLEOTIDE CHROMATOGRAPHY TRANSGENOMIC, INC. (US) 2001-09-13 WO claimed
WO-2001066218-A1 CHROMATOGRAPHIC METHOD FOR RNA STABILIZATION TRANSGENOMIC, INC. (US) 2001-09-13 WO claimed
WO-2001002418-A1 METHOD AND SYSTEM FOR RNA ANALYSIS BY MATCHED ION POLYNUCLEOTIDE CHROMATOGRAPHY TRANSGENOMIC, INC. (US) 2001-01-11 WO claimed
EP-1056528-A1 METHOD FOR HIGH RESOLUTION LIQUID CHROMATOGRAPHIC SEPARATION OF POLYNUCLEOTIDES TRANSGENOMIC, Inc. (US) 2000-12-06 EP claimed
US-6066258-A MATCHED ION POLYNUCLEOTIDE CHROMATOGRAPHY. TRANSGENOMIC, INC. (US) 2000-05-23 US claimed
US-6056877-A APPLYING MIXTURE TO NONPOROUS BEADS WITH HYDROCARBON COATING; CHROMATOGRAPHY TRANSGENOMIC, INC. (US) 2000-05-02 US claimed
US-6024878-A CHROMATOGRAPHIC METHOD FOR SEPARATING A MIXTURE OF HETERODUPLEX AND HOMODUPLEX DNA MOLECULES UNDER CONDITIONS WHICH SELECTIVELY DENATURE A MUTATION SITE PRESENT IN THE HETERODUPLEX DNA MOLECULE TRANSGENOMIC, INC. (US) 2000-02-15 US claimed
WO-1999022839-A1 METHOD FOR HIGH RESOLUTION LIQUID CHROMATOGRAPHIC SEPARATION OF POLYNUCLEOTIDES TRANSGENOMIC, INC. (US) 1999-05-14 WO claimed