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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50495646'   
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 2


(Homo sapiens (Human))		BDBM50495646
PNG
(CHEMBL3114346)
Show SMILES CC1CCC(CC1)NC(=O)c1cccnc1OCc1ccc(F)cc1 |(1.66,-54.17,;2.43,-52.84,;1.66,-51.5,;2.42,-50.16,;3.97,-50.17,;4.75,-51.5,;3.98,-52.84,;4.73,-48.83,;3.97,-47.48,;2.42,-47.48,;4.73,-46.15,;3.97,-44.81,;4.73,-43.47,;6.29,-43.47,;7.06,-44.81,;6.29,-46.15,;7.06,-47.48,;8.59,-47.49,;9.36,-48.82,;8.59,-50.14,;9.35,-51.47,;10.89,-51.47,;11.66,-52.81,;11.66,-50.13,;10.89,-48.81,)|
Show InChI InChI=1S/C20H23FN2O2/c1-14-4-10-17(11-5-14)23-19(24)18-3-2-12-22-20(18)25-13-15-6-8-16(21)9-7-15/h2-3,6-9,12,14,17H,4-5,10-11,13H2,1H3,(H,23,24)
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PC cid
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Article
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 80n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes after 90 mins

Eur J Med Chem 74: 524-32 (2014)


Article DOI: 10.1016/j.ejmech.2013.10.070
BindingDB Entry DOI: 10.7270/Q21V5HXR
More data for this
Ligand-Target Pair