Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nitric oxide synthase, inducible' and Ligand = 'BDBM50063301'   

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, inducible (Homo sapiens (Human))	BDBM50063301 (CHEMBL164596 | N-((5S,6R)-5-Amino-6,7-dihydroxy-he...) Show SMILES CC(=N)NCCCC[C@H](N)[C@@H](O)CO Show InChI InChI=1S/C9H21N3O2/c1-7(10)12-5-3-2-4-8(11)9(14)6-13/h8-9,13-14H,2-6,11H2,1H3,(H2,10,12)/t8-,9-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Searle Curated by ChEMBL					Assay Description Compound was evaluated for the Inhibition of induced isoform of Inducible nitric oxide synthase				J Med Chem 41: 775-7 (1998) Article DOI: 10.1021/jm9706675 BindingDB Entry DOI: 10.7270/Q2VQ31TX
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