Malic Acid

Malic Acid

SCHEMBL7569002

O.O.O.O.O=C([O-])CC(O)C(=O)[O-].[Na+].[Na+]

nearest known ligand 0.94

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Known targets — ChEMBL curated mechanism

CACNA1CCACNA1DCACNA1FCACNA1SCSF1RDRD2FLT1FLT3FLT4HTR1BHTR1DHTR1FKDRKITMETOPRD1OPRK1OPRM1PDGFRAPDGFRBRET

The experimentally established mechanism targets of Malic 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
CA4 P22748 4/20 0.94
CA2 P00918 1/20 0.48
CTSL P07711 1/20 0.44
SLC22A16 Q86VW1 1/20 0.41
CASP1 P29466 1/20 0.36
LMNA P02545 1/20 0.34
CPT2 P23786 1/20 0.33
CPT1A P50416 1/20 0.33
OR51E2 Q9H255 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CA1 P00915 1/20 0.33

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
Malic Acid SCHEMBL7573233 1.00 CA4 (0.94) CA4CA2CTSLSLC22A16CASP1
Malic Acid SCHEMBL10906789 1.00 CA4 (0.94) CA4CA2CTSLSLC22A16CASP1
Malic Acid SCHEMBL7574684 1.00 CA4 (0.94) CA4CA2CTSLSLC22A16CASP1
Malic Acid SCHEMBL4269588 1.00 CA4 (0.94) CA4CA2CTSLSLC22A16CASP1
Malic Acid SCHEMBL29094234 0.97 CA4 (1.00) CA4CA2CTSLSLC22A16CASP1
Malic Acid SCHEMBL30697337 0.97 CA4 (1.00) CA4CA2CTSLSLC22A16CASP1
Malic Acid SCHEMBL21815132 0.97 CA4 (1.00) CA4CA2CTSLSLC22A16CASP1
Malic Acid SCHEMBL123089 0.97 CA4 (1.00) CA4CA2CTSLSLC22A16CASP1
Malic Acid SCHEMBL11056334 0.94 CA4 (0.89) CA4CA2CTSLSLC22A16CASP1
Malic Acid SCHEMBL11599545 0.94 CA4 (0.89) CA4CA2CTSLSLC22A16CASP1

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
US-20020045027-A1 Anti-fog resin sheet, anti-fog agent and method article DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-04-18 US disclosed
EP-1184408-A2 Anti-fog resin sheet, anti-fog agent and molded article DAINIPPON INK AND CHEMICALS, INC. (JP) 2002-03-06 EP disclosed