Fumaric Acid

Fumaric Acid

SCHEMBL4345633

O=C([O-])/C=C\C(=O)[O-].O=S(=O)([O-])C=Cc1ccccc1.O=S(=O)([O-])C=Cc1ccccc1.[Na+].[Na+].[Na+].[Na+]

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

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 20)

geneUniProtsupporting neighboursconfidence
PPARG known ✓ P37231 2/20 0.42
KMT2A known ✓ Q03164 1/20 0.42
LMNA P02545 4/20 0.46
HDAC3 O15379 2/20 0.46
HDAC4 P56524 2/20 0.46
HDAC1 Q13547 2/20 0.46
HDAC2 Q92769 2/20 0.46
HDAC8 Q9BY41 2/20 0.46
HDAC6 Q9UBN7 2/20 0.46
PLIN1 O60240 2/20 0.46
MAPT P10636 2/20 0.46
RECQL P46063 2/20 0.46
PLIN5 Q00G26 2/20 0.46
ABHD5 Q8WTS1 2/20 0.46
ALDH1A1 P00352 2/20 0.46
TNKS O95271 1/20 0.46
HCAR2 Q8TDS4 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46

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 SCHEMBL4345636 1.00 LMNA (0.46) LMNAHDAC3HDAC4HDAC1HDAC2
Fumaric Acid SCHEMBL4346408 1.00 LMNA (0.46) LMNAHDAC3HDAC4HDAC1HDAC2
Fumaric Acid SCHEMBL4346409 0.90 LMNA (0.46) LMNAHDAC3HDAC4HDAC1HDAC2
Acrylic Acid SCHEMBL6279451 0.88 HTT (0.42) LMNAHDAC3HDAC4HDAC1HDAC2
Maleic Acid SCHEMBL27753546 0.88 HDAC3 (0.57) LMNAHDAC3HDAC4HDAC1HDAC2
Fumaric Acid SCHEMBL8655504 0.88 HDAC3 (0.57) LMNAHDAC3HDAC4HDAC1HDAC2
Maleic Acid SCHEMBL4270458 0.88 HDAC3 (0.57) LMNAHDAC3HDAC4HDAC1HDAC2
SCHEMBL28984070 0.87 PPARG (0.52) LMNAHDAC3HDAC4HDAC1HDAC2
SCHEMBL2064222 0.87 PPARG (0.52) LMNAALDH1A1SMN1; SMN2HTTPPARG
SCHEMBL4339905 0.87 PPARG (0.52) LMNAALDH1A1SMN1; SMN2HTTPPARG

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-8367251-B2 Anode with lithium containing ionic polymer coat, method of manufacturing same, secondary battery, and method of manufacturing same SONY CORPORATION (JP) 2013-02-05 US disclosed
US-20090061325-A1 ANODE, METHOD OF MANUFACTURING SAME, SECONDARY BATTERY, AND METHOD OF MANUFACTURING SAME SONY CORPORATION (JP) 2009-03-05 US disclosed