Fumaric Acid

Fumaric Acid

SCHEMBL1835362

NCCO.NCCO.O=C(O)/C=C/C(=O)O

nearest known ligand 0.56

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Known targets — ChEMBL curated mechanism

ADRB1ADRB2ATP4AATP4BAXLCHRM2CHRM3DRD2FLT3HRH1HTR2AHTR2BHTR2CKCNH2KMT2AMAP2K1MAP2K2MEN1MLNRPLK4RENS1PR1SLC6A2SLC6A4atpAatpBatpCatpDatpEatpFatpFHatpGpol

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 20)

geneUniProtsupporting neighboursconfidence
KMT2A known ✓ Q03164 2/20 0.54
MEN1 known ✓ O00255 1/20 0.54
TSHR P16473 6/20 0.56
TP53 P04637 1/20 0.56
EGLN1 Q9GZT9 1/20 0.56
EGLN3 Q9H6Z9 1/20 0.56
GABRR1 P24046 3/20 0.52
GABRR2 P28476 3/20 0.52
BLM P54132 3/20 0.52
GABRR3 A8MPY1 2/20 0.52
LMNA P02545 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
APEX1 P27695 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
ALDH1A1 P00352 2/20 0.50
HCAR2 Q8TDS4 4/20 0.39
GLRA1 P23415 1/20 0.37
SLC6A9 P48067 1/20 0.37
OR51E2 Q9H255 1/20 0.37
GABRP O00591 3/20 0.36

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
Maleic Acid SCHEMBL5874279 1.00 TSHR (0.56) TSHRTP53EGLN1EGLN3KMT2A
Fumaric Acid SCHEMBL3965703 1.00 TSHR (0.56) TSHRTP53EGLN1EGLN3KMT2A
Maleic Acid SCHEMBL30550381 1.00 TSHR (0.56) TSHRTP53EGLN1EGLN3KMT2A
Maleic Acid SCHEMBL3118035 1.00 TSHR (0.56) TSHRTP53EGLN1EGLN3KMT2A
Fumaric Acid SCHEMBL27921137 1.00 TSHR (0.56) TSHRTP53EGLN1EGLN3KMT2A
Maleic Acid SCHEMBL28650191 1.00 TSHR (0.56) TSHRTP53EGLN1EGLN3KMT2A
Fumaric Acid SCHEMBL8771350 1.00 TSHR (0.56) TSHRTP53EGLN1EGLN3KMT2A
Maleic Acid SCHEMBL18065037 0.87 TSHR (0.64) TSHRTP53EGLN1EGLN3KMT2A
Fumaric Acid SCHEMBL2840791 0.87 TSHR (0.64) TSHRTP53EGLN1EGLN3KMT2A
Maleic Acid SCHEMBL786851 0.87 TSHR (0.64) TSHRTP53EGLN1EGLN3KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109476803-B Amine compositions useful for making polyurethane foams 赢创运营有限公司 2022-04-12 CN disclosed
US-9328220-B2 Liquids INNOVIA FILMS LIMITED (GB) 2016-05-03 US disclosed
US-8992798-B2 Liquids INNOVIA FILMS LIMITED (GB) 2015-03-31 US disclosed
US-8784686-B2 Liquids INNOVIA FILMS LIMITED (GB) 2014-07-22 US disclosed
US-20140187684-A1 LIQUIDS INNOVIA FILMS LIMITED (GB) 2014-07-03 US disclosed
US-20110257433-A1 LIQUIDS THE UNIVERSITY OF YORK (GB) 2011-10-20 US disclosed
EP-2322497-A1 Ionic liquids comprising nitrogen containing cations Innovia Films Limited (GB) 2011-05-18 EP disclosed
US-20070185330-A1 Liquids THE UNIVERSITY OF YORK (GB) 2007-08-09 US disclosed
US-7128976-B2 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2006-10-31 US disclosed
US-20030091838-A1 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2003-05-15 US disclosed