Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50027248'   

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))	BDBM50027248 (CHEMBL2113311) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]51CC[C@]2(OC)[C@@H](CNC\C=C\c2ccccc2)C1)ccc3O |THB:10:9:5.4.6:14| Show InChI InChI=1S/C30H36N2O3/c1-32-16-14-29-25-21-10-11-23(33)26(25)35-27(29)30(34-2)13-12-28(29,24(32)17-21)18-22(30)19-31-15-6-9-20-7-4-3-5-8-20/h3-11,22,24,27,31,33H,12-19H2,1-2H3/b9-6+/t22-,24-,27-,28-,29+,30+/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.390	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bath Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from human cloned mu opioid receptor				J Med Chem 50: 5176-82 (2007) Article DOI: 10.1021/jm070255o BindingDB Entry DOI: 10.7270/Q2RR202P
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50027248 (CHEMBL2113311) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]51CC[C@]2(OC)[C@@H](CNC\C=C\c2ccccc2)C1)ccc3O |THB:10:9:5.4.6:14| Show InChI InChI=1S/C30H36N2O3/c1-32-16-14-29-25-21-10-11-23(33)26(25)35-27(29)30(34-2)13-12-28(29,24(32)17-21)18-22(30)19-31-15-6-9-20-7-4-3-5-8-20/h3-11,22,24,27,31,33H,12-19H2,1-2H3/b9-6+/t22-,24-,27-,28-,29+,30+/m1/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	5.5	n/a	n/a	n/a	n/a
University of Bath Curated by ChEMBL					Assay Description Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding				J Med Chem 50: 5176-82 (2007) Article DOI: 10.1021/jm070255o BindingDB Entry DOI: 10.7270/Q2RR202P
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50027248 (CHEMBL2113311) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]51CC[C@]2(OC)[C@@H](CNC\C=C\c2ccccc2)C1)ccc3O |THB:10:9:5.4.6:14| Show InChI InChI=1S/C30H36N2O3/c1-32-16-14-29-25-21-10-11-23(33)26(25)35-27(29)30(34-2)13-12-28(29,24(32)17-21)18-22(30)19-31-15-6-9-20-7-4-3-5-8-20/h3-11,22,24,27,31,33H,12-19H2,1-2H3/b9-6+/t22-,24-,27-,28-,29+,30+/m1/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	26	n/a	n/a	n/a	n/a
University of Bath Curated by ChEMBL					Assay Description Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding				J Med Chem 50: 5176-82 (2007) Article DOI: 10.1021/jm070255o BindingDB Entry DOI: 10.7270/Q2RR202P
					More data for this Ligand-Target Pair