Fumaric Acid

Fumaric Acid

SCHEMBL9626562

C=CC(=O)O.CCC(CO)(CO)CO.O=C(O)C=CC(=O)O.O=C(O)C=CC(=O)O

nearest known ligand 0.42

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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 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
TP53 P04637 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.39
HCAR2 Q8TDS4 6/20 0.38
TSHR P16473 3/20 0.38
EGLN1 Q9GZT9 1/20 0.38
EGLN3 Q9H6Z9 1/20 0.38
THRB P10828 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ACHE P22303 1/20 0.31
BACE1 P56817 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
Acrylic Acid SCHEMBL8927624 0.94 LMNA (0.48) LMNATP53ALDH1A1CYP3A4MAPK1
Acrylic Acid SCHEMBL2688353 0.94 LMNA (0.48) LMNATP53ALDH1A1CYP3A4MAPK1
Acrylic Acid SCHEMBL6685086 0.94 LMNA (0.48) LMNATP53ALDH1A1CYP3A4MAPK1
Acrylic Acid SCHEMBL5694042 0.94 LMNA (0.48) LMNATP53ALDH1A1CYP3A4MAPK1
Acrylic Acid SCHEMBL2470338 0.94 LMNA (0.48) LMNATP53ALDH1A1CYP3A4MAPK1
Acrylic Acid SCHEMBL898587 0.94 LMNA (0.48) LMNATP53ALDH1A1CYP3A4MAPK1
Acrylic Acid SCHEMBL899017 0.94 LMNA (0.48) LMNATP53ALDH1A1CYP3A4MAPK1
Acrylic Acid SCHEMBL134219 0.94 LMNA (0.48) LMNATP53ALDH1A1CYP3A4MAPK1
Acrylic Acid SCHEMBL5933800 0.94 LMNA (0.48) LMNATP53ALDH1A1CYP3A4MAPK1
Acrylic Acid SCHEMBL28238860 0.94 LMNA (0.48) LMNATP53ALDH1A1CYP3A4MAPK1

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-5096767-A Containing radiation curable polymer MITSUBISHI PAPER MILLS LIMITED (JP) 1992-03-17 US disclosed