Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Dopamine beta-hydroxylase' and Ligand = 'BDBM50017827'   

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
Dopamine beta-hydroxylase (Bos taurus)	BDBM50017827 (4-(1-Aminomethyl-vinyl)-phenol | CHEMBL330118) Show SMILES NCC(=C)c1ccc(O)cc1 Show InChI InChI=1S/C9H11NO/c1-7(6-10)8-2-4-9(11)5-3-8/h2-5,11H,1,6,10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	5.20E+5	n/a	n/a	n/a	n/a	n/a	n/a	5.0	n/a
Smith Kline & French Laboratories Curated by ChEMBL					Assay Description KI value was determined from plots of 1/kinact(observed) vs 1/[inhibitor]; Apparent values at pH 5.0, 0.24 mM O2				J Med Chem 31: 704-6 (1988) BindingDB Entry DOI: 10.7270/Q26972KP
					More data for this Ligand-Target Pair
Dopamine beta-hydroxylase (Bos taurus)	BDBM50017827 (4-(1-Aminomethyl-vinyl)-phenol | CHEMBL330118) Show SMILES NCC(=C)c1ccc(O)cc1 Show InChI InChI=1S/C9H11NO/c1-7(6-10)8-2-4-9(11)5-3-8/h2-5,11H,1,6,10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	5.20E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pennsylvania State University Curated by ChEMBL					Assay Description Compound was evaluated for the ability to bind to dopamine beta-hydroxylase of bovine				J Med Chem 32: 735-7 (1989) BindingDB Entry DOI: 10.7270/Q2QZ2908
					More data for this Ligand-Target Pair