Fumaric Acid

Fumaric Acid

SCHEMBL9602434

CN(C)CCCOc1ccc(N2N=C3c4ccccc4SCC3CC2=O)cc1.O=C(O)/C=C/C(=O)O

nearest known ligand 0.42

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 20)

geneUniProtsupporting neighboursconfidence
KMT2A known ✓ Q03164 5/20 0.42
MEN1 known ✓ O00255 4/20 0.42
HRH1 known ✓ P35367 1/20 0.36
L3MBTL1 Q9Y468 4/20 0.42
RAD52 P43351 1/20 0.42
GAA P10253 3/20 0.40
MAPT P10636 3/20 0.40
KDM4E B2RXH2 2/20 0.40
CYP2C19 P33261 1/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
RCE1 Q9Y256 1/20 0.40
BCHE P06276 4/20 0.38
ACHE P22303 4/20 0.38
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 2/20 0.36
MAPK14 Q16539 1/20 0.36
CACNA1B Q00975 1/20 0.35
MAOB P27338 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
Fumaric Acid SCHEMBL9602442 1.00 KMT2A (0.42) KMT2AL3MBTL1MEN1RAD52GAA
SCHEMBL9601582 0.93 MAPK14 (0.40) KMT2AMEN1GAAMAPTKDM4E
Fumaric Acid SCHEMBL9867764 0.90 L3MBTL1 (0.40) KMT2AL3MBTL1MEN1RAD52GAA
Fumaric Acid SCHEMBL9865749 0.88 KMT2A (0.40) KMT2AL3MBTL1MEN1RAD52GAA
Fumaric Acid SCHEMBL10445212 0.88 KMT2A (0.40) KMT2AL3MBTL1MEN1RAD52GAA
Fumaric Acid SCHEMBL9603065 0.86 ALDH1A1 (0.34) KMT2AL3MBTL1MEN1RAD52GAA
Fumaric Acid SCHEMBL9603068 0.86 ALDH1A1 (0.34) KMT2AL3MBTL1MEN1RAD52GAA
Fumaric Acid SCHEMBL10445064 0.84 MAOB (0.44) L3MBTL1KDM4EPOLBBCHEACHE
Fumaric Acid SCHEMBL9865075 0.84 MAOB (0.44) L3MBTL1KDM4EPOLBBCHEACHE
SCHEMBL9603113 0.81 MAPT (0.37) KMT2AMEN1GAAMAPTTDP1

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
EP-0351435-B1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1993-08-04 EP disclosed