Fumaric Acid

Fumaric Acid

SCHEMBL28090533

CC(C)(N)C(C)(C)N.O=C(O)/C=C/C(=O)O

nearest known ligand 0.56

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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 2/20 0.38
MEN1 known ✓ O00255 1/20 0.37
TSHR P16473 5/20 0.56
TP53 P04637 1/20 0.56
EGLN1 Q9GZT9 1/20 0.56
EGLN3 Q9H6Z9 1/20 0.56
HCAR2 Q8TDS4 4/20 0.43
GABRP O00591 2/20 0.42
GABRD O14764 2/20 0.42
GABRA1 P14867 2/20 0.42
GABRB1 P18505 2/20 0.42
GABRG2 P18507 2/20 0.42
GABRB3 P28472 2/20 0.42
GABRA5 P31644 2/20 0.42
GABRA3 P34903 2/20 0.42
GABRA2 P47869 2/20 0.42
GABRB2 P47870 2/20 0.42
GABRA4 P48169 2/20 0.42
GABRE P78334 2/20 0.42
GABRA6 Q16445 2/20 0.42

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 SCHEMBL9617453 0.90 TSHR (0.60) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL9273797 0.85 TSHR (0.53) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL9273791 0.85 TSHR (0.53) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL15822280 0.80 TSHR (0.47) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL15822283 0.80 TSHR (0.47) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL4770527 0.80 TSHR (0.64) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL4770513 0.80 TSHR (0.64) TSHRTP53EGLN1EGLN3HCAR2
Fumaric Acid SCHEMBL27577950 0.80 TSHR (0.64) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL8050273 0.80 TSHR (0.64) TSHRTP53EGLN1EGLN3HCAR2
Maleic Acid SCHEMBL6830928 0.80 TSHR (0.64) 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
CN-103958059-B Hydrosilylation reaction catalysts and curable compositions and methods of making and using the same 道康宁公司 2017-04-26 CN disclosed
CN-103842368-B Iridium containing hydrosilylation catalysts and compositions containing the catalysts 道康宁公司 2017-02-22 CN disclosed
CN-103814040-B Nickel-containing hydrosilylation catalysts and compositions containing the same 道康宁公司 2016-08-31 CN disclosed