Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50343253'   

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))	BDBM50343253 (CHEMBL1773748 | Dimethyl 5-((2S,4aR,6aR,7R,9S,10aS...) Show SMILES COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)C1=CC2OC1C(C(=O)OC)=C2C(=O)OC |r,c:39,t:29,TLB:32:31:26.27:29,THB:37:36:26.27:29,22:26:29:36.31| Show InChI InChI=1S/C29H34O12/c1-12(30)39-17-10-15(24(32)36-4)28(2)8-7-14-25(33)41-18(11-29(14,3)23(28)21(17)31)13-9-16-19(26(34)37-5)20(22(13)40-16)27(35)38-6/h9,14-18,22-23H,7-8,10-11H2,1-6H3/t14-,15-,16?,17-,18-,22?,23-,28-,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Iowa Curated by ChEMBL					Assay Description Displacement of [3H]DADLE from delta opioid receptor				J Nat Prod 74: 718-26 (2011) Article DOI: 10.1021/np1007872 BindingDB Entry DOI: 10.7270/Q2PR7W9V
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