Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50494301'   

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))	BDBM50494301 (CHEMBL3086303) Show SMILES [H][C@]12Cc3ccc(OC)cc3[C@@]3(CCN1CC1CC1)Cc1nc(N)sc1C[C@@]23[H] |r,THB:15:14:27:10.3.2| Show InChI InChI=1S/C22H27N3OS/c1-26-15-5-4-14-8-19-17-10-20-18(24-21(23)27-20)11-22(17,16(14)9-15)6-7-25(19)12-13-2-3-13/h4-5,9,13,17,19H,2-3,6-8,10-12H2,1H3,(H2,23,24)/t17-,19+,22+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.70	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 transfected in CHO cells after 60 mins				J Med Chem 56: 8872-8 (2013) Article DOI: 10.1021/jm401290y BindingDB Entry DOI: 10.7270/Q2KH0R96
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50494301 (CHEMBL3086303) Show SMILES [H][C@]12Cc3ccc(OC)cc3[C@@]3(CCN1CC1CC1)Cc1nc(N)sc1C[C@@]23[H] |r,THB:15:14:27:10.3.2| Show InChI InChI=1S/C22H27N3OS/c1-26-15-5-4-14-8-19-17-10-20-18(24-21(23)27-20)11-22(17,16(14)9-15)6-7-25(19)12-13-2-3-13/h4-5,9,13,17,19H,2-3,6-8,10-12H2,1H3,(H2,23,24)/t17-,19+,22+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	640	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 transfected in CHO cells assessed as inhibition of DAMGO-induced [35S]GTPgammaS binding after 60 mins...				J Med Chem 56: 8872-8 (2013) Article DOI: 10.1021/jm401290y BindingDB Entry DOI: 10.7270/Q2KH0R96
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50494301 (CHEMBL3086303) Show SMILES [H][C@]12Cc3ccc(OC)cc3[C@@]3(CCN1CC1CC1)Cc1nc(N)sc1C[C@@]23[H] |r,THB:15:14:27:10.3.2| Show InChI InChI=1S/C22H27N3OS/c1-26-15-5-4-14-8-19-17-10-20-18(24-21(23)27-20)11-22(17,16(14)9-15)6-7-25(19)12-13-2-3-13/h4-5,9,13,17,19H,2-3,6-8,10-12H2,1H3,(H2,23,24)/t17-,19+,22+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	39	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Agonist activity at human mu opioid receptor transfected in CHO cells assessed as stimulation of [35S]GTPgammaS binding after 60 mins by scintillatio...				J Med Chem 56: 8872-8 (2013) Article DOI: 10.1021/jm401290y BindingDB Entry DOI: 10.7270/Q2KH0R96
					More data for this Ligand-Target Pair