Fumaric Acid

Fumaric Acid

SCHEMBL9247129

CC(O)C(C)O.O=C(O)C=CC(=O)O

nearest known ligand 0.60

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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 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.60
TP53 P04637 2/20 0.60
EGLN1 Q9GZT9 1/20 0.60
EGLN3 Q9H6Z9 1/20 0.60
HCAR2 Q8TDS4 5/20 0.52
ALDH1A1 P00352 3/20 0.52
GAA P10253 1/20 0.52
GABRP O00591 2/20 0.50
GABRD O14764 2/20 0.50
GABRA1 P14867 2/20 0.50
GABRB1 P18505 2/20 0.50
GABRG2 P18507 2/20 0.50
GABRB3 P28472 2/20 0.50
GABRA5 P31644 2/20 0.50
GABRA3 P34903 2/20 0.50
GABRA2 P47869 2/20 0.50
GABRB2 P47870 2/20 0.50
GABRA4 P48169 2/20 0.50
GABRE P78334 2/20 0.50
GABRA6 Q16445 2/20 0.50

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 SCHEMBL27910379 1.00 TSHR (0.60) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL28573037 0.90 TSHR (0.56) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL28568144 0.90 TSHR (0.56) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL27659186 0.90 TSHR (0.64) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL27875534 0.90 TSHR (0.64) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL7489586 0.90 TSHR (0.64) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL16681176 0.88 TP53 (0.65) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL16681178 0.88 TP53 (0.65) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL1835364 0.84 GABRP (0.62) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL1835366 0.84 GABRP (0.62) TSHRTP53EGLN1EGLN3HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5451667-A SPORICIDES, MICROBIOCIDES SPEISER PETER P (CH) 1995-09-19 US disclosed
US-5149695-A Antipsoriatic, antimicrobial SPEISER PETER P (CH) 1992-09-22 US disclosed
US-4851439-A TREATMENT OF PSORIASIS SPEISER PETER P (CH) 1989-07-25 US disclosed