Fumaric Acid

Fumaric Acid

SCHEMBL5509708

O=C(O)/C=C/C(=O)O.O=S(=O)(O)O.[Fe].[NaH]

nearest known ligand 0.60

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 20)

geneUniProtsupporting neighboursconfidence
KMT2A known ✓ Q03164 2/20 0.33
MEN1 known ✓ O00255 1/20 0.33
TSHR P16473 4/20 0.60
TP53 P04637 1/20 0.60
EGLN1 Q9GZT9 1/20 0.60
EGLN3 Q9H6Z9 1/20 0.60
CA5A P35218 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
HCAR2 Q8TDS4 4/20 0.39
INMT O95050 1/20 0.35
GABRR1 P24046 2/20 0.35
GABRR2 P28476 2/20 0.35
BLM P54132 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
GABRR3 A8MPY1 1/20 0.35
LMNA P02545 1/20 0.35
APEX1 P27695 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 3/20 0.35
GAA P10253 1/20 0.35

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 SCHEMBL7551164 0.97 TSHR (0.64) TSHRTP53EGLN1EGLN3CA5A
Fumaric Acid SCHEMBL18224111 0.97 TSHR (0.64) TSHRTP53EGLN1EGLN3CA5A
Fumaric Acid SCHEMBL16914549 0.97 TSHR (0.64) TSHRTP53EGLN1EGLN3CA5A
Maleic Acid SCHEMBL11768683 0.97 TSHR (0.64) TSHRTP53EGLN1EGLN3CA5A
Fumaric Acid SCHEMBL15055651 0.93 TSHR (0.60) TSHRTP53EGLN1EGLN3CA5A
Fumaric Acid SCHEMBL6057963 0.93 TSHR (0.60) TSHRTP53EGLN1EGLN3CA5A
Fumaric Acid SCHEMBL6095324 0.93 TSHR (0.69) TSHRTP53EGLN1EGLN3CA5A
Fumaric Acid SCHEMBL6095338 0.93 TSHR (0.69) TSHRTP53EGLN1EGLN3CA5A
Maleic Acid SCHEMBL11860272 0.93 TSHR (0.69) TSHRTP53EGLN1EGLN3CA5A
Fumaric Acid SCHEMBL9813915 0.90 TSHR (0.64) TSHRTP53EGLN1EGLN3CA5A

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
EP-1791441-A1 MINERAL FEED SUPPLEMENT CAN TECHNOLOGIES, INC. (US) 2007-06-06 EP disclosed
WO-2006034098-A1 MINERAL FEED SUPPLEMENT CAN TECHNOLOGIES, INC. (US) 2006-03-30 WO disclosed