Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nitric oxide synthase, endothelial' and Ligand = 'BDBM50141074'   

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, endothelial (Homo sapiens (Human))	BDBM50141074 (6-{7-[2-(4-Methyl-piperazin-1-yl)-ethoxy]-indan-4-...) Show SMILES CN1CCN(CCOc2ccc(c3CCCc23)-c2cccc(N)n2)CC1 Show InChI InChI=1S/C21H28N4O/c1-24-10-12-25(13-11-24)14-15-26-20-9-8-17(16-4-2-5-18(16)20)19-6-3-7-21(22)23-19/h3,6-9H,2,4-5,10-15H2,1H3,(H2,22,23)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.03E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description In vitro inhibition of human endothelial nitric oxide synthase				J Med Chem 47: 1575-86 (2004) Article DOI: 10.1021/jm030519g BindingDB Entry DOI: 10.7270/Q2J102MT
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