Maleic Acid

Maleic Acid

SCHEMBL10513423

CN1CC=C(c2c[nH]c3ccc(CC(N)=O)cc23)CC1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.66

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Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2BTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3MPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PPARGSLC6A2SLC6A3SLC6A4SMOTYK2pol

The experimentally established mechanism targets of Maleic 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
SLC6A4 known ✓ P31645 4/20 0.60
NOS3 P29474 2/20 0.56
NOS1 P29475 2/20 0.56
NOS2 P35228 2/20 0.56

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 SCHEMBL10513433 1.00 SLC6A4 (0.60) SLC6A4NOS3NOS1NOS2
Fumaric Acid SCHEMBL9764595 0.81 HTR6 (0.51)
Maleic Acid SCHEMBL9764590 0.81 HTR6 (0.51)
SCHEMBL3379399 0.80 SLC6A4 (0.71) SLC6A4
SCHEMBL7205038 0.80 SLC6A4 (0.65) SLC6A4
Fumaric Acid SCHEMBL7483151 0.79 NOS3 (0.62) SLC6A4NOS3NOS1
Fumaric Acid SCHEMBL7483149 0.79 NOS3 (0.62) SLC6A4NOS3NOS1
SCHEMBL7209936 0.79 SLC6A4 (0.67) SLC6A4
Fumaric Acid SCHEMBL8870626 0.79 SLC6A4 (0.64) SLC6A4NOS3NOS1
Fumaric Acid SCHEMBL8869522 0.79 SLC6A4 (0.57) SLC6A4NOS3NOS1

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
EP-0303506-A2 Indole derivatives GLAXO GROUP LIMITED (GB) 1989-02-15 EP disclosed