Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Luciferin 4-monooxygenase' and Ligand = 'BDBM50004850'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Luciferin 4-monooxygenase (Photinus pyralis)	BDBM50004850 (CHEMBL2324094) Show SMILES COc1ccc(cc1)C1=NOC(C)(Cc2ccccc2)C1 |t:9| Show InChI InChI=1S/C18H19NO2/c1-18(12-14-6-4-3-5-7-14)13-17(19-21-18)15-8-10-16(20-2)11-9-15/h3-11H,12-13H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
University of Eastern Finland Curated by ChEMBL					Assay Description Inhibition of recombinant firefly luciferase after 20 mins by luminescence assay				J Med Chem 56: 1064-73 (2013) Article DOI: 10.1021/jm301516q BindingDB Entry DOI: 10.7270/Q20G3MP0
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