Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50019832'   

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
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50019832 ((2-{2-[2-Guanidino-3-(4-hydroxy-phenyl)-propionyla...) Show SMILES [#6]-[#8]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6][S+]([#6])[#8-])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)\[#7]=[#6](/[#7])-[#7] Show InChI InChI=1S/C27H36N6O7S/c1-40-23(35)16-30-24(36)21(14-17-6-4-3-5-7-17)32-25(37)20(12-13-41(2)39)31-26(38)22(33-27(28)29)15-18-8-10-19(34)11-9-18/h3-11,20-22,34H,12-16H2,1-2H3,(H,30,36)(H,31,38)(H,32,37)(H4,28,29,33)/t20-,21-,22-,41?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	285	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Evaluated for the inhibition of [3H]DADLE binding to Opioid receptor delta 1 of guinea pig brain				J Med Chem 30: 1538-42 (1987) BindingDB Entry DOI: 10.7270/Q20Z73VC
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