Maleic Acid

Maleic Acid

SCHEMBL2919006

CCCC[Sn]CCCC.O=C(O)/C=C\C(=O)O.OC(O)(O)C(O)(O)O.OC(O)(O)C(O)(O)O

nearest known ligand 0.44

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 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.44
ACHE P22303 1/20 0.37
BACE1 P56817 1/20 0.37
PLA2G1B P04054 6/20 0.37
ATG4B Q9Y4P1 6/20 0.37
TSHR P16473 2/20 0.36
TP53 P04637 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
EGLN3 Q9H6Z9 1/20 0.36
THRA P10827 1/20 0.36
THRB P10828 1/20 0.36
CYP1A2 P05177 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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 SCHEMBL3685225 0.92 HCAR2 (0.50) HCAR2ACHEBACE1PLA2G1BATG4B
Maleic Acid SCHEMBL538717 0.92 HCAR2 (0.50) HCAR2ACHEBACE1PLA2G1BATG4B
Maleic Acid SCHEMBL1274105 0.92 HCAR2 (0.50) HCAR2ACHEBACE1PLA2G1BATG4B
Fumaric Acid SCHEMBL48773 0.92 HCAR2 (0.50) HCAR2ACHEBACE1PLA2G1BATG4B
Maleic Acid SCHEMBL28530087 0.90 HCAR2 (0.48) HCAR2ACHEBACE1PLA2G1BATG4B
Maleic Acid SCHEMBL3629094 0.90 HCAR2 (0.48) HCAR2ACHEBACE1PLA2G1BATG4B
Maleic Acid SCHEMBL28981641 0.86 HCAR2 (0.46) HCAR2ACHEBACE1PLA2G1BATG4B
Maleic Acid SCHEMBL28649558 0.86 HCAR2 (0.52) HCAR2PLA2G1BATG4BTHRATHRB
Fumaric Acid SCHEMBL901027 0.83 HCAR2 (0.53) HCAR2PLA2G1BATG4BTHRATHRB
Maleic Acid SCHEMBL900756 0.83 HCAR2 (0.53) HCAR2PLA2G1BATG4BTHRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2220174-A1 COATING AGENT WITH DOUBLE CROSS-LINKING Henkel AG & Co. KGaA (DE) 2010-08-25 EP disclosed
WO-2009074365-A1 COATING AGENT WITH DOUBLE CROSS-LINKING HENKEL AG & CO. KGAA (DE) 2009-06-18 WO disclosed