Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50416468'   

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
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50416468 (CHEMBL1209644) Show SMILES CCN1[C@@H](C)CN(C[C@H]1C)C(=O)c1cn2[C@@H](COc3cccc1c23)C1CCCCC1 |r| Show InChI InChI=1S/C25H35N3O2/c1-4-27-17(2)13-26(14-18(27)3)25(29)21-15-28-22(19-9-6-5-7-10-19)16-30-23-12-8-11-20(21)24(23)28/h8,11-12,15,17-19,22H,4-7,9-10,13-14,16H2,1-3H3/t17-,18+,22-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.98	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Agonist activity at human cannabinoid CB1 receptor expressed in CHO cells after 5 hrs by luciferase reporter gene assay				Bioorg Med Chem Lett 20: 4918-21 (2010) Article DOI: 10.1016/j.bmcl.2010.06.067 BindingDB Entry DOI: 10.7270/Q21R6RS6
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