Maleic Acid

Maleic Acid

SCHEMBL5328849

CCCOc1ccc(F)cc1N1CCN(CCCN2C(=O)C3CC(O)C(O)CC3C2=O)CC1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.43

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 14)

geneUniProtsupporting neighboursconfidence
DRD2 known ✓ P14416 5/20 0.43
HTR1A known ✓ P08908 2/20 0.43
HTR2A known ✓ P28223 1/20 0.43
ADRA1A known ✓ P35348 3/20 0.42
ADRA1D known ✓ P25100 2/20 0.42
ADRA1B known ✓ P35368 2/20 0.42
HTR2C known ✓ P28335 1/20 0.37
DRD3 P35462 3/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HTR7 P34969 1/20 0.37

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 SCHEMBL5328856 1.00 DRD2 (0.43) DRD2HTR1AHTR2AADRA1AADRA1D
SCHEMBL4530606 0.94 DRD2 (0.47) DRD2HTR1AHTR2AADRA1AADRA1D
Hydrochloric Acid SCHEMBL4515496 0.93 DRD2 (0.47) DRD2HTR1AHTR2AADRA1AADRA1D
Succinic Acid SCHEMBL5331536 0.93 DRD2 (0.43) DRD2HTR1AHTR2AADRA1AADRA1D
Cadaverine Tartrate SCHEMBL5330833 0.92 DRD2 (0.43) DRD2HTR1AHTR2AADRA1AADRA1D
Phosphoric Acid SCHEMBL5330059 0.91 DRD2 (0.45) DRD2HTR1AHTR2AADRA1AADRA1D
Maleic Acid SCHEMBL5331109 0.88 DRD2 (0.44) DRD2HTR1AHTR2AADRA1AADRA1D
Fumaric Acid SCHEMBL5325595 0.88 DRD2 (0.44) DRD2HTR1AHTR2AADRA1AADRA1D
Maleic Acid SCHEMBL5335594 0.85 DRD2 (0.47) DRD2HTR1AHTR2AADRA1AADRA1D
Fumaric Acid SCHEMBL5306537 0.85 DRD2 (0.47) DRD2HTR1AHTR2AADRA1AADRA1D

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-2007010504-A2 ACID ADDITION SALTS OF ISOINDOLES ACTING AS ADRENERGIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-01-25 WO disclosed