Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50098209'   

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))	BDBM50098209 (22-cyclopropylmethyl-9-(3,4-diformylphenylcarboxam...) Show SMILES Oc1ccc2CC3N(CC4CC4)CC[C@@]45C(Oc1c24)c1[nH]c2c(NC(=O)c4ccc(C=O)c(C=O)c4)cccc2c1C[C@@]35O |TLB:17:18:42:7.13.12,3:4:42:7.13.12| Show InChI InChI=1S/C35H31N3O6/c39-16-21-7-6-20(12-22(21)17-40)33(42)36-25-3-1-2-23-24-14-35(43)27-13-19-8-9-26(41)31-28(19)34(35,10-11-38(27)15-18-4-5-18)32(44-31)30(24)37-29(23)25/h1-3,6-9,12,16-18,27,32,37,41,43H,4-5,10-11,13-15H2,(H,36,42)/t27?,32?,34-,35+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Binding affinity towards mu-opioid receptor from CHO cells				J Med Chem 44: 1017-20 (2001) BindingDB Entry DOI: 10.7270/Q2QF8TK6
					More data for this Ligand-Target Pair