Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nitric oxide synthase, brain' and Ligand = 'BDBM50206069'   

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
Nitric oxide synthase, brain (Homo sapiens (Human))	BDBM50206069 (CHEMBL389312 | N-{2-[1-(tetrahydro-pyran-4-yl)-pip...) Show SMILES NC(=Nc1ccc2nc(NC3CCN(CC3)C3CCOCC3)sc2c1)c1cccs1 |w:2.2| Show InChI InChI=1S/C22H27N5OS2/c23-21(19-2-1-13-29-19)24-16-3-4-18-20(14-16)30-22(26-18)25-15-5-9-27(10-6-15)17-7-11-28-12-8-17/h1-4,13-15,17H,5-12H2,(H2,23,24)(H,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
NeurAxon Inc. Curated by ChEMBL					Assay Description Inhibition of human neuronal NOS activity				Bioorg Med Chem Lett 17: 2540-4 (2007) Article DOI: 10.1016/j.bmcl.2007.02.011 BindingDB Entry DOI: 10.7270/Q2WM1F6B
					More data for this Ligand-Target Pair