Fumaric Acid

Fumaric Acid

SCHEMBL8669997

Cc1cc(Cc2c[nH]cn2)c(C)s1.O=C(O)/C=C/C(=O)O

nearest known ligand 0.30

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 1)

geneUniProtsupporting neighboursconfidence
▸ PLA2G10 O15496 1/20 0.30

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 SCHEMBL8670002 1.00 PLA2G10 (0.30) PLA2G10
Fumaric Acid SCHEMBL6969269 0.80 KDM4E (0.32) —
Fumaric Acid SCHEMBL6969275 0.80 KDM4E (0.32) —
Fumaric Acid SCHEMBL6971276 0.78 MAPT (0.43) —
Fumaric Acid SCHEMBL6971267 0.78 MAPT (0.43) —
Fumaric Acid SCHEMBL6972355 0.77 CYP1A2 (0.31) —
Fumaric Acid SCHEMBL6972364 0.77 CYP1A2 (0.31) —
Fumaric Acid SCHEMBL6972062 0.76 MAPT (0.35) —
Fumaric Acid SCHEMBL6972073 0.76 MAPT (0.35) —
Fumaric Acid SCHEMBL6960373 0.74 MAPT (0.33) —

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-5750720-A ALPHA-ADRENORECEPTORS AND CENTRAL NERVOUS SYSTEMS ORTHO PHARMACEUTICAL CORPORATION (US) 1998-05-12 — — US disclosed
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