BDBM50404722 CHEMBL155958

SMILES: OC(=O)c1cnc2cc(OCc3cccc4ccccc34)ccc2c1O

InChI Key: InChIKey=BRKXEERDYJTXIZ-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50404722   

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))	BDBM50404722 (CHEMBL155958) Show SMILES OC(=O)c1cnc2cc(OCc3cccc4ccccc34)ccc2c1O Show InChI InChI=1S/C21H15NO4/c23-20-17-9-8-15(10-19(17)22-11-18(20)21(24)25)26-12-14-6-3-5-13-4-1-2-7-16(13)14/h1-11H,12H2,(H,22,23)(H,24,25)	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.32E+4	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