Acetic Acid

Acetic Acid

SCHEMBL3892913

CC(=O)[O-].CC(=O)[O-].CCCNCCC.CCCNCCC.[Pd+2]

nearest known ligand 0.54

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
PAOX Q6QHF9 1/20 0.54
CA1 P00915 3/20 0.44
FFAR3 O14843 2/20 0.39
HDAC3 O15379 2/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
ADH1B P00325 1/20 0.38
ADH1A P07327 1/20 0.38
ADH7 P40394 1/20 0.38
CES1 P23141 2/20 0.36
CES2 O00748 1/20 0.36
NPSR1 Q6W5P4 2/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
ANPEP P15144 1/20 0.35
TSHR P16473 2/20 0.35
ALDH1A1 P00352 1/20 0.35

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
Acetone SCHEMBL2672348 0.85 PAOX (0.61) PAOXCA1HDAC3HDAC1HDAC2
Acetone SCHEMBL4367700 0.82 PAOX (0.58) PAOXCA1ADH1BADH1AADH7
Acetic Acid SCHEMBL6367218 0.82 PAOX (0.58) PAOXCA1FFAR3HDAC3HDAC1
Acetic Acid SCHEMBL7063721 0.80 ALDH1A1 (0.59) PAOXADH1BADH1AADH7CES1
Acetic Acid SCHEMBL7561331 0.80 PAOX (0.56) PAOXCA1FFAR3HDAC3HDAC1
Bicarbonate SCHEMBL28444878 0.79 PAOX (0.54) PAOXCA1FFAR3HDAC3HDAC1
Acetic Acid SCHEMBL21412814 0.79 TSHR (0.50) PAOXCA1ADH1BADH1AADH7
Acetic Acid SCHEMBL5503587 0.78 CA1 (0.61) CA1FFAR3HDAC3HDAC1HDAC2
Acetic Acid SCHEMBL5265226 0.78 CA1 (0.61) CA1FFAR3HDAC3HDAC1HDAC2
Diethanolamine SCHEMBL7559033 0.78 CA1 (0.44) PAOXCA1ALDH1A1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0866486-B1 Method of production of electron source substrate provided with electron emitting elements and method of production of image forming apparatus using the substrate CANON KK (JP) 2009-01-14 EP disclosed
US-7442405-B2 Method for production of electron source substrate provided with electron emitting element and method for production of electronic device using the substrate CANON KABUSHIKI KAISHA (JP) 2008-10-28 US disclosed
US-20040213897-A1 Method for production of electron source substrate provided with electron emitting element and method for production of electronic device using the substrate CANON KABUSHIKI KAISHA (JP) 2004-10-28 US disclosed
US-20030026893-A1 Method for production of electron source substrate provided with electron emitting element and method for production of electronic device using the substrate MIYAMOTO MASAHIKO (JP) 2003-02-06 US disclosed
US-6514559-B1 High efficiency with less shape irregularity CANON KABUSHIKI KAISHA (JP) 2003-02-04 US disclosed
EP-0736890-B1 Metal-containing compostition for forming electron-emitting device and methods of manufacturing electron-emitting device, electron source and image-forming apparatus CANON KK (JP) 2002-07-31 EP disclosed
EP-1124247-A1 Metal-containing composition for forming electron-emitting device and methods of manufacturing electron-emitting device,electron source and image-forming apparatus CANON KABUSHIKI KAISHA (JP) 2001-08-16 EP disclosed
US-6270389-B1 Method for forming an electron-emitting device using a metal-containing composition CANON KABUSHIKI KAISHA (JP) 2001-08-07 US disclosed
US-6123876-A COMPOUND CONTAINING AN ORGANIC ACID GROUP, A TRANSITION METAL AND AN ALCOHOL AMINE, AND WATER. CANON KABUSHIKI KAISHA (JP) 2000-09-26 US disclosed
EP-0866486-A2 Method for production of electron source substrate provided with electron emitting element and method for production of electronic device using the substrate CANON KABUSHIKI KAISHA (JP) 1998-09-23 EP disclosed
EP-0736890-A1 Metal-containing compostition for forming electron-emitting device and methods of manufacturing electron-emitting device, electron source and image-forming apparatus CANON KABUSHIKI KAISHA (JP) 1996-10-09 EP disclosed