Fumaric Acid

Fumaric Acid

SCHEMBL8959756

COc1cn(CCN)c2cccc(C)c12.O=C(O)/C=C/C(=O)O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

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 6)

geneUniProtsupporting neighboursconfidence
FLT3 known ✓ P36888 1/20 0.36
TRPM5 Q9NZQ8 13/20 0.47
HTR7 P34969 5/20 0.41
ALDH1A1 P00352 1/20 0.37
KDR P35968 1/20 0.36
GSK3B P49841 1/20 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
Fumaric Acid SCHEMBL8959767 1.00 TRPM5 (0.47) TRPM5HTR7ALDH1A1KDRFLT3
SCHEMBL8959995 0.89 TRPM5 (0.44) TRPM5KDRFLT3GSK3B
Fumaric Acid SCHEMBL8959671 0.84 HTR2C (0.45) TRPM5HTR7
Fumaric Acid SCHEMBL8959661 0.84 HTR2C (0.45) TRPM5HTR7
Fumaric Acid SCHEMBL8959560 0.79 TRPM5 (0.36) TRPM5ALDH1A1
Fumaric Acid SCHEMBL8959571 0.79 TRPM5 (0.36) TRPM5ALDH1A1
SCHEMBL8959761 0.74 TRPM5 (0.39) TRPM5ALDH1A1
SCHEMBL8959667 0.74 TRPM5 (0.38) TRPM5HTR7
Fumaric Acid SCHEMBL8959605 0.73 HTR6 (0.48) ALDH1A1KDRFLT3GSK3B
Fumaric Acid SCHEMBL8959622 0.73 HTR6 (0.48) ALDH1A1KDRFLT3GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5494928-A FOR CENTRAL NERVOUS SYSTEM DISORDERS, BLOCKING SEROTONIN RECEPTORS, ANTIDEPRESSANTS HOFFMANN-LA ROCHE INC. (US) 1996-02-27 US disclosed