Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50323005'   

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 (Rattus norvegicus (rat))	BDBM50323005 (1'-(5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)-1-(3...) Show SMILES CC1(C)CCN(CC1)C1(CCN(CC1)C(=O)c1cc(c(-c2ccc(Cl)cc2)n1CCCNS(C)(=O)=O)-c1ccc(Cl)cc1Cl)C(N)=O Show InChI InChI=1S/C34H42Cl3N5O4S/c1-33(2)11-19-41(20-12-33)34(32(38)44)13-17-40(18-14-34)31(43)29-22-27(26-10-9-25(36)21-28(26)37)30(23-5-7-24(35)8-6-23)42(29)16-4-15-39-47(3,45)46/h5-10,21-22,39H,4,11-20H2,1-3H3,(H2,38,44)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.30	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-aventis R&D Curated by ChEMBL					Assay Description Binding affinity to CB1 receptor in rat brain synaptosomal membranes				Bioorg Med Chem Lett 20: 4573-7 (2010) Article DOI: 10.1016/j.bmcl.2010.06.017 BindingDB Entry DOI: 10.7270/Q28G8KV6
					More data for this Ligand-Target Pair