Fumaric Acid

Fumaric Acid

SCHEMBL8415339

Cn1cc(CCCNc2cccnc2)c2ccccc21.O=C(O)C=CC(=O)O

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol

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
MEN1 known ✓ O00255 2/20 0.48
KMT2A known ✓ Q03164 2/20 0.48
HTR2C known ✓ P28335 1/20 0.44
KDM4E B2RXH2 2/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 3/20 0.45
RXFP1 Q9HBX9 2/20 0.45
TP53 P04637 1/20 0.45
HTR7 P34969 2/20 0.43
HDAC3 O15379 4/20 0.43
HDAC1 Q13547 4/20 0.43
HDAC6 Q9UBN7 4/20 0.43
ALDH1A1 P00352 2/20 0.43
HDAC4 P56524 3/20 0.43
HDAC7 Q8WUI4 3/20 0.43
HDAC2 Q92769 3/20 0.43
HDAC8 Q9BY41 3/20 0.43
HDAC9 Q9UKV0 3/20 0.43
HDAC5 Q9UQL6 3/20 0.43

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 SCHEMBL8415335 1.00 MEN1 (0.48) MEN1KMT2AKDM4EHPGDHSD17B10
SCHEMBL9054532 0.91 HTR2C (0.49) MEN1KMT2AKDM4EHPGDHSD17B10
SCHEMBL9056570 0.84 HTR2C (0.51) MEN1KMT2AKDM4EHPGDHSD17B10
SCHEMBL8418207 0.78 HTR2A (0.51) MEN1KMT2AKDM4EHPGDHSD17B10
SCHEMBL8804198 0.77 NOTUM (0.62) MEN1KMT2AKDM4EHPGDHSD17B10
Fumaric Acid SCHEMBL8416954 0.76 HTR2C (0.60) MEN1KMT2AKDM4ELMNARXFP1
Maleic Acid SCHEMBL8416947 0.76 HTR2C (0.60) MEN1KMT2AKDM4ELMNARXFP1
SCHEMBL8804773 0.74 PTPN5 (0.64) MEN1KMT2AKDM4ELMNAALDH1A1
SCHEMBL8415336 0.74 KDM4E (0.41) MEN1KMT2AKDM4EHPGDHSD17B10
Maleic Acid SCHEMBL7323806 0.71 HTR3A (0.60) MEN1KMT2AKDM4EHPGDHSD17B10

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
US-5965582-A ANTIHISTAMINES ASTA MEDICA AKTIENGESELLSCHAFT (DE) 1999-10-12 US disclosed