Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50354652'   

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))	BDBM50354652 (CHEMBL1834249) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NC1Cc2ccccc2CN(CC(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)C(N)=O)C1=O |r| Show InChI InChI=1S/C41H50N8O10/c1-23(44-38(56)30(42)17-24-8-12-28(51)13-9-24)37(55)46-32-19-26-5-2-3-6-27(26)20-48(40(32)58)21-35(53)45-31(18-25-10-14-29(52)15-11-25)41(59)49-16-4-7-34(49)39(57)47-33(22-50)36(43)54/h2-3,5-6,8-15,23,30-34,50-52H,4,7,16-22,42H2,1H3,(H2,43,54)(H,44,56)(H,45,53)(H,46,55)(H,47,57)/t23-,30+,31+,32?,33+,34+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Brussel Curated by ChEMBL					Assay Description Agonist activity at delta-type opioid receptor				J Med Chem 54: 6538-47 (2011) Article DOI: 10.1021/jm2003574 BindingDB Entry DOI: 10.7270/Q24Q7VC1
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