Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50027005'   

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))	BDBM50027005 (CHEMBL2112843) Show SMILES [H][C@@]12Cc3ccccc3[C@@]([H])(c3ccccc13)[C@]([H])(C(C)C)N2C |TLB:4:3:22.17:11.16,12:11:22.17:8.2.3,THB:23:22:11.16:8.2.3,19:17:11.16:8.2.3,7:8:22.17:11.16| Show InChI InChI=1S/C20H23N/c1-13(2)20-19-15-9-5-4-8-14(15)12-18(21(20)3)16-10-6-7-11-17(16)19/h4-11,13,18-20H,12H2,1-3H3/t18-,19+,20+/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	695	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Montr£al Curated by ChEMBL					Assay Description In vitro binding affinity against cloned human Opioid receptor mu 1 expressed in HEK 293S cells				J Med Chem 46: 34-48 (2002) Article DOI: 10.1021/jm020164l BindingDB Entry DOI: 10.7270/Q2TM7BTT
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