Maleic Acid

Maleic Acid

SCHEMBL8057348

CC1=C(C(=O)O)CC1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

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 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
TP53 P04637 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
EGLN3 Q9H6Z9 1/20 0.41
CYP1A2 P05177 1/20 0.38
ALDH1A1 P00352 3/20 0.36
HTT P42858 2/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HCAR2 Q8TDS4 3/20 0.35
NMT1 P30419 1/20 0.33
INMT O95050 1/20 0.32
GAA P10253 2/20 0.31
NPC1 O15118 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALOX15 P16050 1/20 0.31
RECQL P46063 1/20 0.31

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
SCHEMBL623976 0.88
Acrylic Acid SCHEMBL5216290 0.84 LMNA (0.43) CYP1A2ALDH1A1LMNAALOX15HSD17B10
Maleic Acid SCHEMBL1072943 0.81 HCAR2 (0.36) TSHRTP53EGLN1EGLN3CYP1A2
Vinyl Chloride SCHEMBL2305839 0.80
Methacrylic Acid SCHEMBL7855533 0.76 LMNA (0.31) TSHRLMNA
SCHEMBL3151880 0.75 HCAR2 (0.40) ALDH1A1HTTMAPTHCAR2ALOX15
SCHEMBL757738 0.73 POLB (0.35) TSHRCYP1A2ALDH1A1MAPTNPSR1
SCHEMBL765594 0.73
Maleic Acid SCHEMBL9579937 0.72 HCAR2 (0.36) TSHRTP53EGLN1EGLN3HCAR2
Monomethyl Fumarate SCHEMBL3148636 0.72 HCAR2 (0.68) TSHRTP53EGLN1EGLN3ALDH1A1

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-6051643-A Resin composite and method for producing the same KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2000-04-18 US disclosed