Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50380907'   

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 (MOUSE)	BDBM50380907 (CHEMBL2016676) Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)[C@@]1(O)CC[C@@]35N(C1)C(=O)c1ccccc1 |r,THB:26:24:22.21:14.15| Show InChI InChI=1S/C28H30N2O4/c31-20-9-8-19-14-21-28-11-10-26(33,16-30(28)24(32)18-4-2-1-3-5-18)25-27(28,22(19)23(20)34-25)12-13-29(21)15-17-6-7-17/h1-5,8-9,17,21,25,31,33H,6-7,10-16H2/t21-,25+,26-,27+,28-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	10.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Displacement of [3H]U-69,593 from mouse brain delta opioid receptor				Bioorg Med Chem Lett 22: 2689-92 (2012) Article DOI: 10.1016/j.bmcl.2012.03.001 BindingDB Entry DOI: 10.7270/Q24X58T4
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