Maleic Acid

Maleic Acid

SCHEMBL6697953

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

nearest known ligand 0.60

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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 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.60
TP53 P04637 1/20 0.60
EGLN1 Q9GZT9 1/20 0.60
EGLN3 Q9H6Z9 1/20 0.60
ALDH1A1 P00352 5/20 0.46
TDP1 Q9NUW8 3/20 0.46
ALOX15 P16050 2/20 0.46
RECQL P46063 2/20 0.46
HSD17B10 Q99714 2/20 0.46
HCAR2 Q8TDS4 5/20 0.46
GAA P10253 1/20 0.40
GABRP O00591 2/20 0.38
GABRD O14764 2/20 0.38
GABRA1 P14867 2/20 0.38
GABRB1 P18505 2/20 0.38
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRA5 P31644 2/20 0.38
GABRA3 P34903 2/20 0.38
GABRA2 P47869 2/20 0.38

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 SCHEMBL11123967 1.00 TSHR (0.60) TSHRTP53EGLN1EGLN3ALDH1A1
Fumaric Acid SCHEMBL29778246 1.00 TSHR (0.60) TSHRTP53EGLN1EGLN3ALDH1A1
Fumaric Acid SCHEMBL6697956 1.00 TSHR (0.60) TSHRTP53EGLN1EGLN3ALDH1A1
SCHEMBL11777328 0.85 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
SCHEMBL6136073 0.85 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
SCHEMBL7534023 0.85 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
SCHEMBL7535770 0.85 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
SCHEMBL11305485 0.85 TSHR (0.50) TSHRTP53EGLN1EGLN3ALDH1A1
Fumaric Acid SCHEMBL15689651 0.82 TSHR (0.75) TSHRTP53EGLN1EGLN3ALDH1A1
Maleic Acid SCHEMBL8032158 0.82 TSHR (0.75) 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
WO-2004113415-A1 POWDER COATING COMPOSITION FOR LOW TEMPERATURE CURE DSM IP ASSETS B.V. (NL) 2004-12-29 WO disclosed