Maleic Acid

Maleic Acid

SCHEMBL11635486

N=C(N=Cc1ccccc1C1CC1)NN.O=C(O)/C=C\C(=O)O

nearest known ligand 0.32

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 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.32
BLM P54132 1/20 0.32
HSD17B10 Q99714 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
NFKB1 P19838 1/20 0.31
CA4 P22748 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 1/20 0.31
GLA P06280 1/20 0.31
POLB P06746 1/20 0.31
MAPK1 P28482 1/20 0.31
PMP22 Q01453 1/20 0.31
KMT2A Q03164 1/20 0.31
MAOB P27338 1/20 0.30

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
SCHEMBL11638545 0.91 L3MBTL1 (0.33) HSD17B10
Maleic Acid SCHEMBL11635484 0.80 MAPT (0.40) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL21314143 0.72 CA1 (0.55) LMNASMN1; SMN2CA1CA2NFKB1
Maleic Acid SCHEMBL11635543 0.71 SMN1; SMN2 (0.39) LMNASMN1; SMN2MAPTKDM4EALDH1A1
Maleic Acid SCHEMBL11635392 0.71 CA12 (0.44) LMNACA2MAPTKDM4EALDH1A1
SCHEMBL11638543 0.69 GAA (0.42) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL11638550 0.69 GAA (0.42) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL11875368 0.68 GRIN1 (0.49) LMNASMN1; SMN2MAPTKDM4EALDH1A1
SCHEMBL11882884 0.68 GRIN2D (0.50) LMNASMN1; SMN2ALDH1A1MEN1POLB
SCHEMBL1158588 0.66 LMNA (0.43) LMNASMN1; SMN2CA1CA2TAAR1

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
US-4109008-A SUBSTITUTED WITH AN AMIDINO AND A 1,3-DIMETHYL-2-OXO-BENZIMIDAZOL- 5-YL RADICAL HEXACHIMIE (FR) 1978-08-22 US disclosed