BDBM23228 Oxamic acid derivative, 6::[(2-cyano-4-{2-[(5-hydroxy-2-{[(4-methoxyphenyl)methyl]carbamoyl}-4-oxo-4H-chromen-7-yl)oxy]ethyl}phenyl)carbamoyl]formic acid
SMILES: COc1ccc(CNC(=O)c2cc(=O)c3c(O)cc(OCCc4ccc(NC(=O)C(O)=O)c(c4)C#N)cc3o2)cc1
InChI Key: InChIKey=NNFRKDPIXARSJH-UHFFFAOYSA-N
Data: 5 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Lactate Dehydrogenase (Plasmodium falciparum) | BDBM23228 (Oxamic acid derivative, 6 | [(2-cyano-4-{2-[(5-hyd...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.25E+3 | n/a | n/a | n/a | n/a | 7.0 | 25 |
University of Mississippi | Assay Description LDH was assayed spectrophotometrically for reduction of pyruvate using NADH by recording the changed in absorbance at 340 nm. The reaction was initia... | J Med Chem 50: 3841-50 (2007) Article DOI: 10.1021/jm070336k BindingDB Entry DOI: 10.7270/Q2HH6HCV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Lactate Dehydrogenase (Bos taurus (bovine)) | BDBM23228 (Oxamic acid derivative, 6 | [(2-cyano-4-{2-[(5-hyd...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >1.79E+5 | n/a | n/a | n/a | n/a | 7.0 | 25 |
University of Mississippi | Assay Description LDH was assayed spectrophotometrically for reduction of pyruvate using NADH by recording the changed in absorbance at 340 nm. The reaction was initia... | J Med Chem 50: 3841-50 (2007) Article DOI: 10.1021/jm070336k BindingDB Entry DOI: 10.7270/Q2HH6HCV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Malate dehydrogenase cytoplasmic (Sus scrofa (pig)) | BDBM23228 (Oxamic acid derivative, 6 | [(2-cyano-4-{2-[(5-hyd...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.09E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mississippi | Assay Description MDH was assayed spectrophotometrically for reduction of oxaloacetic acid using NADH by recording the changed in absorbance at 340 nm. The reaction wa... | J Med Chem 50: 3841-50 (2007) Article DOI: 10.1021/jm070336k BindingDB Entry DOI: 10.7270/Q2HH6HCV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Malate Dehydrogenase, mitochondrial (Sus scrofa (pig)) | BDBM23228 (Oxamic acid derivative, 6 | [(2-cyano-4-{2-[(5-hyd...) | PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 5.91E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mississippi | Assay Description MDH was assayed spectrophotometrically for reduction of oxaloacetic acid using NADH by recording the changed in absorbance at 340 nm. The reaction wa... | J Med Chem 50: 3841-50 (2007) Article DOI: 10.1021/jm070336k BindingDB Entry DOI: 10.7270/Q2HH6HCV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Malate Dehydrogenase (pfMDH) (Plasmodium falciparum) | BDBM23228 (Oxamic acid derivative, 6 | [(2-cyano-4-{2-[(5-hyd...) | PDB KEGG UniProtKB/TrEMBL GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 8.69E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Mississippi | Assay Description MDH was assayed spectrophotometrically for reduction of oxaloacetic acid using NADH by recording the changed in absorbance at 340 nm. The reaction wa... | J Med Chem 50: 3841-50 (2007) Article DOI: 10.1021/jm070336k BindingDB Entry DOI: 10.7270/Q2HH6HCV | |||||||||||
More data for this Ligand-Target Pair |