Maleic Acid

Maleic Acid

SCHEMBL9602897

Cc1ccc2c(c1)C1=NN(c3ccc(OCCCN4CCCCC4)cc3)C(=O)CC1CC2.O=C(O)/C=C\C(=O)O

nearest known ligand 0.50

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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 9)

geneUniProtsupporting neighboursconfidence
HRH3 known ✓ Q9Y5N1 10/20 0.44
HRH1 known ✓ P35367 2/20 0.42
HTR1A known ✓ P08908 1/20 0.40
KCNH2 Q12809 3/20 0.44
MAPK14 Q16539 3/20 0.43
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
HRH4 Q9H3N8 1/20 0.40
ACHE P22303 1/20 0.40

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 SCHEMBL9602903 1.00 HRH3 (0.44) HRH3KCNH2MAPK14HRH1POLB
Maleic Acid SCHEMBL9865891 0.82 ACHE (0.38) HRH3MAPK14POLBMAPTACHE
Fumaric Acid SCHEMBL9865899 0.82 ACHE (0.38) HRH3MAPK14POLBMAPTACHE
SCHEMBL9602830 0.82 HRH3 (0.48) HRH3KCNH2HTR1AACHE
Hydrochloric Acid SCHEMBL9866019 0.80 DRD2 (0.44) HRH3MAPK14
Hydrochloric Acid SCHEMBL9866011 0.80 DRD2 (0.44) HRH3MAPK14
Fumaric Acid SCHEMBL9868348 0.79 L3MBTL1 (0.37) HRH3MAPK14POLBMAPTACHE
Fumaric Acid SCHEMBL9601552 0.79 L3MBTL1 (0.37) HRH3MAPK14POLBMAPTACHE
SCHEMBL9601558 0.78 MAOB (0.46) HRH3HTR1AACHE
SCHEMBL10365856 0.76 APP (0.44) POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0351435-B1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1993-08-04 EP disclosed
US-5045541-A Immunodeficiency disorders YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-09-03 US disclosed
EP-0351435-A1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-24 EP disclosed