Fumaric Acid

Fumaric Acid

SCHEMBL2457500

CC[N+](C)(CC)CC.O=C([O-])/C=C\C(=O)[O-].[H+]

nearest known ligand 0.50

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Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol

The experimentally established mechanism targets of Fumaric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 5/20 0.48
CA1 P00915 1/20 0.34
CA9 Q16790 1/20 0.34
FFAR3 O14843 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31

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
Fumaric Acid SCHEMBL2451022 0.97 BBOX1 (0.50) BBOX1CA1CA9FFAR3HDAC3
Fumaric Acid SCHEMBL4953861 0.97 BBOX1 (0.50) BBOX1CA1CA9FFAR3HDAC3
Fumaric Acid SCHEMBL2451026 0.97 BBOX1 (0.50) BBOX1CA1CA9FFAR3HDAC3
Fumaric Acid SCHEMBL4926346 0.95 BBOX1 (0.48) BBOX1CA1CA9FFAR3HDAC3
Fumaric Acid SCHEMBL4926333 0.95 BBOX1 (0.48) BBOX1CA1CA9FFAR3HDAC3
Fumaric Acid SCHEMBL4929187 0.95 BBOX1 (0.48) BBOX1CA1CA9FFAR3HDAC3
Fumaric Acid SCHEMBL4929245 0.91 BBOX1 (0.45) BBOX1CA1CA9
Fumaric Acid SCHEMBL2457508 0.91 BBOX1 (0.45) BBOX1CA1CA9
Fumaric Acid SCHEMBL2457505 0.91 BBOX1 (0.45) BBOX1CA1CA9
Fumaric Acid SCHEMBL6853046 0.87 BBOX1 (0.56) BBOX1CA1CA9FFAR3HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1650328-B1 METHOD FOR FORMING OXIDE FILM ON METAL SURFACE USING IONIC LIQUID, ELECTROLYTIC CAPACITOR AND ELECTROLYTE THEREOF KANEKA CORP (JP) 2016-10-19 EP disclosed
EP-2540875-A1 Electrolytic capacitor including ionic liquid in electrolyte KANEKA CORPORATION (JP) 2013-01-02 EP disclosed
US-8014128-B2 Method for forming oxide film on metal surface using ionic liquid, electrolytic capacitor and electrolyte thereof KANEKA CORPORATION (JP) 2011-09-06 US disclosed
US-7746623-B2 Electrolytic capacitor and electrolyte thereof KANEKA CORPORATION (JP) 2010-06-29 US disclosed
US-20080304208-A1 ELECTROLYTIC CAPACITOR AND ELECTROLYTE THEREOF KANEKA CORPORATION 2008-12-11 US disclosed
US-20070263341-A1 Ionic Liquid and Method for Producing the Same, Method for Forming Oxide Film on Metal Surface, Electrolytic Capicitor and Electrolyte KANEKA CORPORATION (JP) 2007-11-15 US disclosed
CN-1829828-A Method for forming oxide film on metal surface using ionic liquid, electrolytic capacitor and electrolyte thereof KANEGAFUCHI CHEMICAL IND (JP) 2006-09-06 CN disclosed
US-20060181835-A1 Method for forming oxide film on metal surface using ionic liquid, electrolytic capacitor and electrolyte thereof KANEKA CORPORATION (JP) 2006-08-17 US disclosed
EP-1650328-A1 METHOD FOR FORMING OXIDE FILM ON METAL SURFACE USING IONIC LIQUID, ELECTROLYTIC CAPACITOR AND ELECTROLYTE THEREOF KANEKA CORPORATION (JP) 2006-04-26 EP disclosed
EP-0708452-B1 Ion-conductive polymer electrolyte, method for producing the electrolyte and capacitors using the electrolyte MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 2004-05-26 EP disclosed
US-6043975-A ELECTROLYTE IS COPOLYMER OF A HYDROXYALKYL (METH) ACRYLATE OR VINYLIDENE CARBONATE AND AMMONIUM CARBOXYLATE SUCH AS TRIETHYLMETHYLAMMONIUM HYDROGEN MALEATE (MAH3E1M), IN WHICH IONS DISSOCIATED FROM MAH3E1M SERVE AS THE CONDUCTIVE SPECIES MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2000-03-28 US disclosed
US-5900182-A SOLID ELECTROLYTE CONTAINING COPOLYMERS OF HYDROXYALKYL ACRYLATES AND QUATERNARY AMMONIUM OR MORPHOLINIUM CARBOXYLATES OR DICARBOXYLATES, STORAGE STABILITY, HEAT RESISTANCE, HIGH CONDUCTIVITY MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1999-05-04 US disclosed
US-5733661-A METAL OXIDE CONTAINING IONS OF AN ORGANIC CARBOXYLIC ACID SALT AND/OR IONS OF AN INORGANIC OXOACID SALT MITSUBISHI CHEMICAL CORPORATION (JP) 1998-03-31 US disclosed
EP-0708452-A1 Ion-conductive polymer electrolyte, method for producing the electrolyte and capacitors using the electrolyte MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1996-04-24 EP disclosed