BDBM50404701 CHEMBL139244

SMILES: OC(=O)c1cnc2cc(ccc2c1O)[N+]([O-])=O

InChI Key: InChIKey=HGHKRTOZDXYURD-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50404701   

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
Malate Dehydrogenase, mitochondrial (Sus scrofa (pig))	BDBM50404701 (CHEMBL139244) Show SMILES OC(=O)c1cnc2cc(ccc2c1O)[N+]([O-])=O Show InChI InChI=1S/C10H6N2O5/c13-9-6-2-1-5(12(16)17)3-8(6)11-4-7(9)10(14)15/h1-4H,(H,11,13)(H,14,15)	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.91E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Ability to inhibit mitochondrial malate dehydrogenase				J Med Chem 25: 57-63 (1982) BindingDB Entry DOI: 10.7270/Q2DR2WQV
					More data for this Ligand-Target Pair
Malate dehydrogenase cytoplasmic (Sus scrofa (pig))	BDBM50404701 (CHEMBL139244) Show SMILES OC(=O)c1cnc2cc(ccc2c1O)[N+]([O-])=O Show InChI InChI=1S/C10H6N2O5/c13-9-6-2-1-5(12(16)17)3-8(6)11-4-7(9)10(14)15/h1-4H,(H,11,13)(H,14,15)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Ability to inhibit cytoplasmic malate dehydrogenase				J Med Chem 25: 57-63 (1982) BindingDB Entry DOI: 10.7270/Q2DR2WQV
					More data for this Ligand-Target Pair