Maleic Acid

Maleic Acid

SCHEMBL4871652

O=C(O)/C=C\C(=O)O.O=C(O)C1=CCC1

nearest known ligand 0.43

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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 5/20 0.43
GABRR1 P24046 2/20 0.43
SLC6A1 P30531 1/20 0.43
SLC6A13 Q9NSD5 1/20 0.43
GABRP O00591 1/20 0.43
GABRD O14764 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRB1 P18505 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
GABRA2 P47869 1/20 0.43
GABRB2 P47870 1/20 0.43
GABRA4 P48169 1/20 0.43
GABRE P78334 1/20 0.43
GABRA6 Q16445 1/20 0.43
GABRG1 Q8N1C3 1/20 0.43
GABRG3 Q99928 1/20 0.43
GABRQ Q9UN88 1/20 0.43

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
SCHEMBL22290 0.87
SCHEMBL17503288 0.87
SCHEMBL11674817 0.85 TSHR (0.50) TSHRGABRR1SLC6A1SLC6A13GABRP
Ammonia Solution, Strong SCHEMBL8678266 0.85
SCHEMBL11674811 0.85 TSHR (0.50) TSHRGABRR1SLC6A1SLC6A13GABRP
Acrylic Acid SCHEMBL1008091 0.84 LMNA (0.46) TSHRGABRR1SLC6A1SLC6A13GABRP
Maleic Acid SCHEMBL725011 0.80 TSHR (0.38) TSHRSLC6A1SLC6A13TP53EGLN1
Acetic Acid SCHEMBL8598462 0.80 TSHR (0.47) TSHRGABRR1SLC6A1SLC6A13GABRP
Vinyl Chloride SCHEMBL11168338 0.79 TSHR (0.42) TSHRGABRR1SLC6A1SLC6A13GABRP
Sulfuric Acid SCHEMBL11001981 0.78 TSHR (0.45) TSHRGABRR1SLC6A1SLC6A13GABRP

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
JP-10250238-A None JP disclosed
US-20080286512-A1 MULTILAYERED LAMINATE FOR TUBES HAVING AN EMBEDDED ALUMINUM LAYER, A PROCESS FOR THE PRODUCTION THEREOF AND A TUBE PRODUCED THEREFROM HUHTAMAKI RONSBERG ZWEIGNIEDERLASSUNG DER HUHTAMAKI DEUTSCHLAND GMBH & CO. KG (DE) 2008-11-20 US disclosed
JP-H10250238-A REWRITING TYPE THERMAL SHEET TOSHIBA CORP 1998-09-22 JP disclosed