Fumaric Acid

Fumaric Acid

SCHEMBL8090876

Cc1ccc2c(c1)CCC(CC1CNC=N1)=C2.O=C(O)/C=C/C(=O)O

nearest known ligand 0.50

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 4)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 1/20 0.30
SLC6A4 known ✓ P31645 1/20 0.30
MCHR1 Q99705 1/20 0.33
ADRA2A P08913 1/20 0.32

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 SCHEMBL8090881 1.00 MCHR1 (0.33) MCHR1ADRA2ASLC6A2SLC6A4
Fumaric Acid SCHEMBL8093372 0.92 ADRA2A (0.36) ADRA2ASLC6A2SLC6A4
Fumaric Acid SCHEMBL8093365 0.92 ADRA2A (0.36) ADRA2ASLC6A2SLC6A4
SCHEMBL6960180 0.90 ADRA2A (0.37) MCHR1ADRA2A
Fumaric Acid SCHEMBL8092403 0.85 ADRA2A (0.46) ADRA2A
Fumaric Acid SCHEMBL8092398 0.85 ADRA2A (0.46) ADRA2A
Fumaric Acid SCHEMBL8091878 0.85 ADRA2A (0.46) ADRA2A
Fumaric Acid SCHEMBL8091870 0.85 ADRA2A (0.46) ADRA2A
Fumaric Acid SCHEMBL8085007 0.85 ADRA2A (0.46) ADRA2A
Fumaric Acid SCHEMBL8085005 0.85 ADRA2A (0.46) ADRA2A

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
CN-1183907-C Imidazoline compound, preparing process thereof and pharmaceutical composition contg. same SERVIER LAB (FR) 2005-01-12 CN disclosed
US-6127396-A Imidazoline compounds ADIR ET COMPAGNIE (FR) 2000-10-03 US disclosed