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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 = 'BDBM50205158'   
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))		BDBM50205158
PNG
(3,5-dichloro-N-((2S,3S)-4-(4-chlorophenyl)-3-(3-cy...)
Show SMILES C[C@@H]([C@@H](Cc1ccc(Cl)cc1)c1cccc(c1)C#N)N(C)S(=O)(=O)c1cc(Cl)cc(Cl)c1
Show InChI InChI=1S/C24H21Cl3N2O2S/c1-16(29(2)32(30,31)23-13-21(26)12-22(27)14-23)24(11-17-6-8-20(25)9-7-17)19-5-3-4-18(10-19)15-28/h3-10,12-14,16,24H,11H2,1-2H3/t16-,24+/m0/s1
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Article
PubMed
n/an/a>2.00E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human recombinant CB2 receptor expressed in CHO cells

Bioorg Med Chem Lett 17: 2184-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.087
BindingDB Entry DOI: 10.7270/Q2HM584G
More data for this
Ligand-Target Pair