Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50250450'   

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))	BDBM50250450 (CHEMBL4103328) Show SMILES [H][C@@]12CCC[C@@]3(OCc4ccccc4)[C@@]4([H])Cc5ccc(O)c(O1)c5[C@@]23CCN4C |r,TLB:29:28:5:24.17.16| Show InChI InChI=1S/C24H27NO3/c1-25-13-12-23-20-8-5-11-24(23,27-15-16-6-3-2-4-7-16)19(25)14-17-9-10-18(26)22(28-20)21(17)23/h2-4,6-7,9-10,19-20,26H,5,8,11-15H2,1H3/t19-,20+,23-,24-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.890	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Innsbruck Curated by ChEMBL					Assay Description Displacement of [3H]-diprenorphine from recombinant human DOR expressed in CHO cell membranes after 60 mins by liquid scintillation counting				J Med Chem 60: 9407-9412 (2017) Article DOI: 10.1021/acs.jmedchem.7b01363 BindingDB Entry DOI: 10.7270/Q2PZ5C72
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