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Compound Detail

CHEMBL449139

SODIUM MALEATE
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O=C([O-])/C=C\C(=O)[O-].[Na+].[Na+]

Basic Information

ChEMBL ID CHEMBL449139
Name SODIUM MALEATE
Phase Preclinical
Structure Type MOL
InChI Key MSJMDZAOKORVFC-UAIGNFCESA-L
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

160.0
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C4H2Na2O4
MW 160.04

Activity Summary

Ki 3 meas. best 5.07

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Carbonic anhydrase
CHEMBL5337
Ki 5.07 5.07 8600.0 1
Unchecked
CHEMBL612545
Ki 5.06 5.06 8700.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Carbonic anhydrase Ki = 8600.0 nM 5.07 Inhibition of Candida albicans Nce103 19297172
Unchecked Ki = 8700.0 nM 5.06 Inhibition of Cryptococcus neoformans Can2 19297172

Literature References

PubMed DOI Target Context # Activities
19297172 10.1016/j.bmc.2009.02.058 Carbonic anhydrase 2 1
19297172 10.1016/j.bmc.2009.02.058 Unchecked 1
19297172 10.1016/j.bmc.2009.02.058 Carbonic anhydrase 1

Data from ChEMBL 36 via Core Engine