Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50072453'   

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 (GUINEA PIG)	BDBM50072453 (3-((4aS,10aS)-2,10a-Dimethyl-1,3,4,5,10,10a-hexahy...) Show SMILES CN1CC[C@@]2(Cc3ccccc3C[C@]2(C)C1)c1cccc(O)c1 Show InChI InChI=1S/C21H25NO/c1-20-13-16-6-3-4-7-17(16)14-21(20,10-11-22(2)15-20)18-8-5-9-19(23)12-18/h3-9,12,23H,10-11,13-15H2,1-2H3/t20-,21-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	119	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Compound was tested for the inhibition of [35S]-GTP-gammaS, binding in Guinea pig Caudate stimulated by the opioid receptor agonist Mu-DAMGO				Bioorg Med Chem Lett 8: 3149-52 (1999) BindingDB Entry DOI: 10.7270/Q2S75FGQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50072453 (3-((4aS,10aS)-2,10a-Dimethyl-1,3,4,5,10,10a-hexahy...) Show SMILES CN1CC[C@@]2(Cc3ccccc3C[C@]2(C)C1)c1cccc(O)c1 Show InChI InChI=1S/C21H25NO/c1-20-13-16-6-3-4-7-17(16)14-21(20,10-11-22(2)15-20)18-8-5-9-19(23)12-18/h3-9,12,23H,10-11,13-15H2,1-2H3/t20-,21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	297	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Binding affinity was determined as ability to displace [3H]-DAMGO radioligand from Mu opioid receptor				Bioorg Med Chem Lett 8: 3149-52 (1999) BindingDB Entry DOI: 10.7270/Q2S75FGQ
					More data for this Ligand-Target Pair