Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50010659'   

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)	BDBM50010659 (CHEMBL3264748) Show SMILES [H][C@]12O[C@]34CC[C@@]5(OCOc6c(O)ccc7C[C@@]3([H])N(CC3CC3)CC[C@]4(c67)[C@]15[H])N(CCc1ccccc1)C2=O |r,TLB:20:19:3:27.15.16,THB:7:6:26:1.2| Show InChI InChI=1S/C31H34N2O5/c34-22-9-8-21-16-23-30-11-12-31-27(26(38-30)28(35)33(31)14-10-19-4-2-1-3-5-19)29(30,24(21)25(22)36-18-37-31)13-15-32(23)17-20-6-7-20/h1-5,8-9,20,23,26-27,34H,6-7,10-18H2/t23-,26+,27+,29+,30-,31+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.20	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]DPDPE from delta opioid receptor in mouse whole brain cerebellum membrane				ACS Med Chem Lett 5: 368-72 (2014) Article DOI: 10.1021/ml400491k BindingDB Entry DOI: 10.7270/Q2GF0W23
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50010659 (CHEMBL3264748) Show SMILES [H][C@]12O[C@]34CC[C@@]5(OCOc6c(O)ccc7C[C@@]3([H])N(CC3CC3)CC[C@]4(c67)[C@]15[H])N(CCc1ccccc1)C2=O |r,TLB:20:19:3:27.15.16,THB:7:6:26:1.2| Show InChI InChI=1S/C31H34N2O5/c34-22-9-8-21-16-23-30-11-12-31-27(26(38-30)28(35)33(31)14-10-19-4-2-1-3-5-19)29(30,24(21)25(22)36-18-37-31)13-15-32(23)17-20-6-7-20/h1-5,8-9,20,23,26-27,34H,6-7,10-18H2/t23-,26+,27+,29+,30-,31+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	0.620	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Agonist activity at human delta opioid receptor expressed in HEK293 cells by CellKey method				ACS Med Chem Lett 5: 368-72 (2014) Article DOI: 10.1021/ml400491k BindingDB Entry DOI: 10.7270/Q2GF0W23
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50010659 (CHEMBL3264748) Show SMILES [H][C@]12O[C@]34CC[C@@]5(OCOc6c(O)ccc7C[C@@]3([H])N(CC3CC3)CC[C@]4(c67)[C@]15[H])N(CCc1ccccc1)C2=O |r,TLB:20:19:3:27.15.16,THB:7:6:26:1.2| Show InChI InChI=1S/C31H34N2O5/c34-22-9-8-21-16-23-30-11-12-31-27(26(38-30)28(35)33(31)14-10-19-4-2-1-3-5-19)29(30,24(21)25(22)36-18-37-31)13-15-32(23)17-20-6-7-20/h1-5,8-9,20,23,26-27,34H,6-7,10-18H2/t23-,26+,27+,29+,30-,31+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	0.410	n/a	n/a	n/a	n/a
Kitasato University Curated by ChEMBL					Assay Description Agonist activity at human delta opioid receptor expressed in CHO cells assessed as [35S]-GTP[gammaS] binding				ACS Med Chem Lett 5: 368-72 (2014) Article DOI: 10.1021/ml400491k BindingDB Entry DOI: 10.7270/Q2GF0W23
					More data for this Ligand-Target Pair