Fumaric Acid

Fumaric Acid

SCHEMBL175130

CC1CNCCc2ccccc21.O=C(O)/C=C/C(=O)O

nearest known ligand 0.74

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 18)

geneUniProtsupporting neighboursconfidence
HTR2C known ✓ P28335 13/20 0.74
HTR2A known ✓ P28223 11/20 0.74
HTR2B known ✓ P41595 10/20 0.74
ADRB1 known ✓ P08588 1/20 0.49
SLC6A2 known ✓ P23975 1/20 0.49
SLC6A4 known ✓ P31645 1/20 0.49
HRH1 known ✓ P35367 1/20 0.49
KCNH2 known ✓ Q12809 1/20 0.49
HTR1A P08908 1/20 0.49
ADRA2A P08913 1/20 0.49
ADRA2B P18089 1/20 0.49
ADRA2C P18825 1/20 0.49
CNR1 P21554 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49
LMNA P02545 1/20 0.46
BLM P54132 1/20 0.46
TSHR P16473 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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 SCHEMBL174415 1.00 HTR2C (0.74) HTR2CHTR2AHTR2BADRB1HTR1A
Fumaric Acid SCHEMBL174417 1.00 HTR2C (0.74) HTR2CHTR2AHTR2BADRB1HTR1A
SCHEMBL164205 0.86 HTR2C (1.00) HTR2CHTR2AHTR2BADRB1HTR1A
Succinic Acid SCHEMBL170444 0.86 HTR2C (0.74) HTR2CHTR2AHTR2BADRB1HTR1A
Malonic Acid SCHEMBL174816 0.86 HTR2C (0.74) HTR2CHTR2AHTR2BADRB1HTR1A
Glycolic Acid SCHEMBL173573 0.86 HTR2C (0.74) HTR2CHTR2AHTR2BADRB1HTR1A
Iodide SCHEMBL174548 0.85 HTR2C (0.96) HTR2CHTR2AHTR2BADRB1HTR1A
Water SCHEMBL16465743 0.85 HTR2C (0.96) HTR2CHTR2AHTR2BADRB1HTR1A
Bromide SCHEMBL174576 0.85 HTR2C (0.96) HTR2CHTR2AHTR2BADRB1HTR1A
Hydrochloric Acid SCHEMBL174589 0.85 HTR2C (0.96) HTR2CHTR2AHTR2BADRB1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611449-A1 ADMINISTRATION OF LORCASERIN TO INDIVIDUALS WITH RENAL IMPAIRMENT Arena Pharmaceuticals, Inc. (US) 2013-07-10 EP disclosed
EP-2611427-A2 MODIFIED-RELEASE DOSAGE FORMS OF 5-HT2C AGONISTS USEFUL FOR WEIGHT MANAGEMENT& xA; Arena Pharmaceuticals, Inc. (US) 2013-07-10 EP disclosed
WO-2012030927-A2 MODIFIED-RELEASE DOSAGE FORMS OF 5-HT2C AGONISTS USEFUL FOR WEIGHT MANAGEMENT ARENA PHARMACEUTICALS, INC. (US) 2012-03-08 WO disclosed
WO-2012030939-A1 ADMINISTRATION OF LORCASERIN TO INDIVIDUALS WITH RENAL IMPAIRMENT ARENA PHARMACEUTICALS, INC. (US) 2012-03-08 WO disclosed