Fumaric Acid

Fumaric Acid

SCHEMBL6235895

O=C(O)/C=C/C(=O)O.O=S(=O)(O)CCS(=O)(=O)O

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DRD2

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 4/20 0.53
TP53 P04637 1/20 0.53
EGLN1 Q9GZT9 1/20 0.53
EGLN3 Q9H6Z9 1/20 0.53
BLM P54132 3/20 0.41
LMNA P02545 2/20 0.41
PTGS1 P23219 1/20 0.41
PDE4A P27815 1/20 0.41
SLC6A6 P31641 1/20 0.41
CYP2C19 P33261 1/20 0.41
GABRR1 P24046 2/20 0.38
GABRR2 P28476 2/20 0.38
APEX1 P27695 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
APP P05067 1/20 0.38
GABRR3 A8MPY1 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HCAR2 Q8TDS4 6/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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 SCHEMBL5792063 0.82 TSHR (0.53) TSHRTP53EGLN1EGLN3BLM
Fumaric Acid SCHEMBL6826914 0.82 TSHR (0.53) TSHRTP53EGLN1EGLN3BLM
Maleic Acid SCHEMBL28227361 0.81 APP (0.39) TSHRTP53EGLN1EGLN3BLM
Fumaric Acid SCHEMBL6095338 0.81 TSHR (0.69) TSHRTP53EGLN1EGLN3BLM
Maleic Acid SCHEMBL11860272 0.81 TSHR (0.69) TSHRTP53EGLN1EGLN3BLM
Fumaric Acid SCHEMBL6095324 0.81 TSHR (0.69) TSHRTP53EGLN1EGLN3BLM
Fumaric Acid SCHEMBL3088427 0.80 TSHR (0.50) TSHRTP53EGLN1EGLN3BLM
Fumaric Acid SCHEMBL3088432 0.80 TSHR (0.50) TSHRTP53EGLN1EGLN3BLM
Maleic Acid SCHEMBL28847233 0.80 TSHR (0.50) TSHRTP53EGLN1EGLN3BLM
SCHEMBL2467911 0.79 BLM (0.42) TSHRTP53EGLN1EGLN3BLM

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
WO-2005007183-A2 TREATMENT OF ANEMIA THROMB-X NV (BE) 2005-01-27 WO disclosed