Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50378889'   

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))	BDBM50378889 (CHEMBL1743605) Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCC(=O)OC1=C2O[C@H]3[C@@H](O)C=C[C@H]4[C@H]5CC(C=C1)C2[C@@]34CCN5C |r,c:37,43,49,TLB:53:52:42:44.45.48| Show InChI InChI=1S/C43H52N4O7/c1-24-18-29(48)19-25(2)30(24)22-34(45(3)4)42(52)47-23-28-9-7-6-8-26(28)20-33(47)41(51)44-16-14-37(50)53-36-13-10-27-21-32-31-11-12-35(49)40-43(31,15-17-46(32)5)38(27)39(36)54-40/h6-13,18-19,27,31-35,38,40,48-49H,14-17,20-23H2,1-5H3,(H,44,51)/t27?,31-,32+,33-,34-,35-,38?,40-,43-/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	3.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Cagliari Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHO cells after 60 mins by scintillation counting				Eur J Med Chem 46: 799-803 (2011) Article DOI: 10.1016/j.ejmech.2010.12.001 BindingDB Entry DOI: 10.7270/Q2CF9R3C
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50378889 (CHEMBL1743605) Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCC(=O)OC1=C2O[C@H]3[C@@H](O)C=C[C@H]4[C@H]5CC(C=C1)C2[C@@]34CCN5C |r,c:37,43,49,TLB:53:52:42:44.45.48| Show InChI InChI=1S/C43H52N4O7/c1-24-18-29(48)19-25(2)30(24)22-34(45(3)4)42(52)47-23-28-9-7-6-8-26(28)20-33(47)41(51)44-16-14-37(50)53-36-13-10-27-21-32-31-11-12-35(49)40-43(31,15-17-46(32)5)38(27)39(36)54-40/h6-13,18-19,27,31-35,38,40,48-49H,14-17,20-23H2,1-5H3,(H,44,51)/t27?,31-,32+,33-,34-,35-,38?,40-,43-/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	450	n/a	n/a	n/a	n/a	n/a	n/a
University of Cagliari Curated by ChEMBL					Assay Description Agonist activity at human mu opioid receptor expressed in CHO cells by [35S]GTPgammaS binding assay				Eur J Med Chem 46: 799-803 (2011) Article DOI: 10.1016/j.ejmech.2010.12.001 BindingDB Entry DOI: 10.7270/Q2CF9R3C
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50378889 (CHEMBL1743605) Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCC(=O)OC1=C2O[C@H]3[C@@H](O)C=C[C@H]4[C@H]5CC(C=C1)C2[C@@]34CCN5C |r,c:37,43,49,TLB:53:52:42:44.45.48| Show InChI InChI=1S/C43H52N4O7/c1-24-18-29(48)19-25(2)30(24)22-34(45(3)4)42(52)47-23-28-9-7-6-8-26(28)20-33(47)41(51)44-16-14-37(50)53-36-13-10-27-21-32-31-11-12-35(49)40-43(31,15-17-46(32)5)38(27)39(36)54-40/h6-13,18-19,27,31-35,38,40,48-49H,14-17,20-23H2,1-5H3,(H,44,51)/t27?,31-,32+,33-,34-,35-,38?,40-,43-/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	29	n/a	n/a	n/a	n/a
University of Cagliari Curated by ChEMBL					Assay Description Agonist activity at human mu opioid receptor expressed in CHO cells by [35S]GTPgammaS binding assay				Eur J Med Chem 46: 799-803 (2011) Article DOI: 10.1016/j.ejmech.2010.12.001 BindingDB Entry DOI: 10.7270/Q2CF9R3C
					More data for this Ligand-Target Pair