Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50300377'   

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
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50300377 (Bis((-)-N-cyclobutylmethylmorphinan-3-yl)2,9-Dimet...) Show SMILES CC(CCCCCCC(C)C(=O)Oc1ccc2C[C@@H]3[C@@H]4CCCC[C@]4(CCN3CC3CCC3)c2c1)C(=O)Oc1ccc2C[C@@H]3[C@@H]4CCCC[C@]4(CCN3CC3CCC3)c2c1 |r| Show InChI InChI=1S/C54H76N2O4/c1-37(51(57)59-43-23-21-41-31-49-45-19-7-9-25-53(45,47(41)33-43)27-29-55(49)35-39-15-11-16-39)13-5-3-4-6-14-38(2)52(58)60-44-24-22-42-32-50-46-20-8-10-26-54(46,48(42)34-44)28-30-56(50)36-40-17-12-18-40/h21-24,33-34,37-40,45-46,49-50H,3-20,25-32,35-36H2,1-2H3/t37?,38?,45-,46-,49+,50+,53+,54+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.950	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHO cells after 60 mins by liquid scintillation counting				J Med Chem 52: 7389-96 (2009) Article DOI: 10.1021/jm900379p BindingDB Entry DOI: 10.7270/Q29P31Q8
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50300377 (Bis((-)-N-cyclobutylmethylmorphinan-3-yl)2,9-Dimet...) Show SMILES CC(CCCCCCC(C)C(=O)Oc1ccc2C[C@@H]3[C@@H]4CCCC[C@]4(CCN3CC3CCC3)c2c1)C(=O)Oc1ccc2C[C@@H]3[C@@H]4CCCC[C@]4(CCN3CC3CCC3)c2c1 |r| Show InChI InChI=1S/C54H76N2O4/c1-37(51(57)59-43-23-21-41-31-49-45-19-7-9-25-53(45,47(41)33-43)27-29-55(49)35-39-15-11-16-39)13-5-3-4-6-14-38(2)52(58)60-44-24-22-42-32-50-46-20-8-10-26-54(46,48(42)34-44)28-30-56(50)36-40-17-12-18-40/h21-24,33-34,37-40,45-46,49-50H,3-20,25-32,35-36H2,1-2H3/t37?,38?,45-,46-,49+,50+,53+,54+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Antagonist activity at human mu opioid receptor expressed in CHO cells assessed as inhibition of DAMGO-stimulated [35S]GTPgammaS binding				J Med Chem 52: 7389-96 (2009) Article DOI: 10.1021/jm900379p BindingDB Entry DOI: 10.7270/Q29P31Q8
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50300377 (Bis((-)-N-cyclobutylmethylmorphinan-3-yl)2,9-Dimet...) Show SMILES CC(CCCCCCC(C)C(=O)Oc1ccc2C[C@@H]3[C@@H]4CCCC[C@]4(CCN3CC3CCC3)c2c1)C(=O)Oc1ccc2C[C@@H]3[C@@H]4CCCC[C@]4(CCN3CC3CCC3)c2c1 |r| Show InChI InChI=1S/C54H76N2O4/c1-37(51(57)59-43-23-21-41-31-49-45-19-7-9-25-53(45,47(41)33-43)27-29-55(49)35-39-15-11-16-39)13-5-3-4-6-14-38(2)52(58)60-44-24-22-42-32-50-46-20-8-10-26-54(46,48(42)34-44)28-30-56(50)36-40-17-12-18-40/h21-24,33-34,37-40,45-46,49-50H,3-20,25-32,35-36H2,1-2H3/t37?,38?,45-,46-,49+,50+,53+,54+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	7.10	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTPgammaS binding				J Med Chem 52: 7389-96 (2009) Article DOI: 10.1021/jm900379p BindingDB Entry DOI: 10.7270/Q29P31Q8
					More data for this Ligand-Target Pair