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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50325880'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Cannabinoid receptor 1


(Homo sapiens (Human))		BDBM50325880
PNG
(CHEMBL1224371 | N-(1-(3-(benzo[d][1,3]dioxol-4-yl)...)
Show SMILES CC(C)(C)C(=O)Nc1ccc2ncn(Cc3cccc(c3)-c3cccc4OCOc34)c2c1
Show InChI InChI=1S/C26H25N3O3/c1-26(2,3)25(30)28-19-10-11-21-22(13-19)29(15-27-21)14-17-6-4-7-18(12-17)20-8-5-9-23-24(20)32-16-31-23/h4-13,15H,14,16H2,1-3H3,(H,28,30)
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n/an/a 64n/an/an/an/an/an/a



Ligand Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]CC55940 human cannabinoid CB1 receptor expressed in CHO cells by luciferase reporter gene assay

Bioorg Med Chem Lett 20: 5449-53 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.091
BindingDB Entry DOI: 10.7270/Q2SN0958
More data for this
Ligand-Target Pair