Maleic Acid

Maleic Acid

SCHEMBL9230995

CN(C)CCCOc1ccc(-c2nn(-c3ccccc3)c3ncccc23)cc1.O=C(O)/C=C\C(=O)O

nearest known ligand 0.45

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 15)

geneUniProtsupporting neighboursconfidence
HRH1 known ✓ P35367 1/20 0.41
LSS P48449 3/20 0.45
PSMB5 P28074 3/20 0.44
BCHE P06276 4/20 0.43
ACHE P22303 4/20 0.43
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PTGER1 P34995 1/20 0.41
PSMB1 P20618 1/20 0.41
CCNA2 P20248 1/20 0.40
CDK2 P24941 1/20 0.40
KDR P35968 1/20 0.39
TGFBR1 P36897 1/20 0.39
ACVR1 Q04771 1/20 0.39
PRKAB1 Q9Y478 1/20 0.39

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 SCHEMBL9231005 1.00 LSS (0.45) LSSPSMB5BCHEACHEHRH1
Maleic Acid SCHEMBL9236893 0.96 LSS (0.45) LSSPSMB5BCHEACHEHRH1
Fumaric Acid SCHEMBL9236898 0.96 LSS (0.45) LSSPSMB5BCHEACHEHRH1
Maleic Acid SCHEMBL9236952 0.95 PSMB5 (0.43) LSSPSMB5BCHEACHEHRH1
Fumaric Acid SCHEMBL9236957 0.95 PSMB5 (0.43) LSSPSMB5BCHEACHEHRH1
Fumaric Acid SCHEMBL9234624 0.94 LSS (0.43) LSSPSMB5BCHEACHEKDM4E
Maleic Acid SCHEMBL9235575 0.94 MAPK14 (0.40) LSSPSMB5BCHEACHEHRH1
Fumaric Acid SCHEMBL9235580 0.94 MAPK14 (0.40) LSSPSMB5BCHEACHEHRH1
Fumaric Acid SCHEMBL9234618 0.94 LSS (0.43) LSSPSMB5BCHEACHEKDM4E
Fumaric Acid SCHEMBL9237516 0.94 BCHE (0.44) LSSPSMB5BCHEACHEHRH1

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
EP-0641564-A1 OPTICALLY ACTIVE CONDENSED PYRAZOLE COMPOUND FOR USE IN TREATING THROMBOCYTOPENIA AND ERYTHROPENIA YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-03-08 EP disclosed