Fumaric Acid

Fumaric Acid

SCHEMBL8953356

C=C(C)C(=O)OCC.C=C(C)C(=O)OCC.O=C(O)/C=C/C(=O)O

nearest known ligand 0.57

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 17)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 1/20 0.39
KMT2A known ✓ Q03164 1/20 0.39
HCAR2 Q8TDS4 5/20 0.57
THRB P10828 1/20 0.52
TSHR P16473 4/20 0.46
GLO1 Q04760 1/20 0.45
ALDH1A1 P00352 7/20 0.44
LMNA P02545 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MAPT P10636 1/20 0.41
CYP2D6 P10635 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39

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 SCHEMBL15653018 1.00 HCAR2 (0.57) HCAR2THRBTSHRGLO1ALDH1A1
Maleic Acid SCHEMBL720767 1.00 HCAR2 (0.57) HCAR2THRBTSHRGLO1ALDH1A1
Acrylic Acid SCHEMBL27651708 0.88 THRB (0.52) HCAR2THRBTSHRGLO1ALDH1A1
Acrylic Acid SCHEMBL265149 0.88 THRB (0.52) HCAR2THRBTSHRGLO1ALDH1A1
Acetic Acid SCHEMBL28298395 0.87 THRB (0.59) THRBTSHRGLO1ALDH1A1LMNA
Bicarbonate SCHEMBL10996730 0.87 THRB (0.59) THRBTSHRGLO1ALDH1A1LMNA
SCHEMBL15030 0.87
SCHEMBL19409375 0.87 THRB (0.64) THRBTSHRGLO1ALDH1A1LMNA
Acrylic Acid SCHEMBL23825514 0.86 THRB (0.50) HCAR2THRBTSHRGLO1ALDH1A1
Acrolein SCHEMBL11765226 0.85 HCAR2 (0.43) HCAR2THRBTSHRGLO1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5529889-A CONTAINING CYANINE COMPOUND CANON KABUSHIKI KAISHA (JP) 1996-06-25 US disclosed
EP-0559101-A1 Heat-developable photosensitive material and image forming method which uses the same CANON KABUSHIKI KAISHA (JP) 1993-09-08 EP disclosed