Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50545483'   

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))	BDBM50545483 (CHEMBL4635947) Show SMILES [H][C@@]12OC3C4C(C[C@@]5([H])N(CC[C@@]14[C@@]5(O)Cc1c2[nH]c2ccccc12)C(=O)C1CC1)=CC=C3OC |r,c:36,38,THB:25:9:13:5.4.6| Show InChI InChI=1S/C27H28N2O4/c1-32-19-9-8-15-12-20-27(31)13-17-16-4-2-3-5-18(16)28-22(17)24-26(27,21(15)23(19)33-24)10-11-29(20)25(30)14-6-7-14/h2-5,8-9,14,20-21,23-24,28,31H,6-7,10-13H2,1H3/t20-,21?,23?,24+,26+,27-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	322	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Inverse agonist activity at human delta opioid receptor expressed in CHO cell membranes by [35S]GTPgammaS binding assay				Bioorg Med Chem Lett 30: (2020) Article DOI: 10.1016/j.bmcl.2020.127176 BindingDB Entry DOI: 10.7270/Q2W380XV
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