Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50238615'   

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))	BDBM50238615 (CHEMBL264967 | Thiophene-2-carboxylic Acid (2S,4aR...) Show SMILES COC(=O)[C@@H]1C[C@H](OC(=O)c2cccs2)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1 |r| Show InChI InChI=1S/C26H28O8S/c1-25-8-6-15-23(29)34-18(14-7-9-32-13-14)12-26(15,2)21(25)20(27)17(11-16(25)22(28)31-3)33-24(30)19-5-4-10-35-19/h4-5,7,9-10,13,15-18,21H,6,8,11-12H2,1-3H3/t15-,16-,17-,18-,21-,25-,26-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Iowa Curated by ChEMBL					Assay Description Displacement of [125I]IOXY from human recombinant mu opioid receptor expressed in CHO cells				J Med Chem 51: 2421-31 (2008) Article DOI: 10.1021/jm701162g BindingDB Entry DOI: 10.7270/Q2DV1KR7
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50238615 (CHEMBL264967 | Thiophene-2-carboxylic Acid (2S,4aR...) Show SMILES COC(=O)[C@@H]1C[C@H](OC(=O)c2cccs2)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1 |r| Show InChI InChI=1S/C26H28O8S/c1-25-8-6-15-23(29)34-18(14-7-9-32-13-14)12-26(15,2)21(25)20(27)17(11-16(25)22(28)31-3)33-24(30)19-5-4-10-35-19/h4-5,7,9-10,13,15-18,21H,6,8,11-12H2,1-3H3/t15-,16-,17-,18-,21-,25-,26-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Iowa Curated by ChEMBL					Assay Description Displacement of [125]OXY from mu opioid receptor				J Nat Prod 69: 914-8 (2006) Article DOI: 10.1021/np060094b BindingDB Entry DOI: 10.7270/Q28W3D22
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50238615 (CHEMBL264967 | Thiophene-2-carboxylic Acid (2S,4aR...) Show SMILES COC(=O)[C@@H]1C[C@H](OC(=O)c2cccs2)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1 |r| Show InChI InChI=1S/C26H28O8S/c1-25-8-6-15-23(29)34-18(14-7-9-32-13-14)12-26(15,2)21(25)20(27)17(11-16(25)22(28)31-3)33-24(30)19-5-4-10-35-19/h4-5,7,9-10,13,15-18,21H,6,8,11-12H2,1-3H3/t15-,16-,17-,18-,21-,25-,26-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.15E+3	n/a	n/a	n/a	n/a
The University of Iowa Curated by ChEMBL					Assay Description Agonist activity at human recombinant mu opioid receptor expressed in CHO cells by [35S]GTP-gamma-S binding assay				J Med Chem 51: 2421-31 (2008) Article DOI: 10.1021/jm701162g BindingDB Entry DOI: 10.7270/Q2DV1KR7
					More data for this Ligand-Target Pair