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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 = 'BDBM50198701'   
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))		BDBM50198701
PNG
(CHEMBL3928040)
Show SMILES C[C@@H](NC(=O)c1nn(c2c1CCCC\C2=C/c1ccc(F)cc1)-c1ccc(Cl)c(Cl)c1)c1ccccn1 |r|
Show InChI InChI=1S/C29H25Cl2FN4O/c1-18(26-8-4-5-15-33-26)34-29(37)27-23-7-3-2-6-20(16-19-9-11-21(32)12-10-19)28(23)36(35-27)22-13-14-24(30)25(31)17-22/h4-5,8-18H,2-3,6-7H2,1H3,(H,34,37)/b20-16+/t18-/m1/s1
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Similars
Article
PubMed
n/an/an/an/a 2.00E+3n/an/an/an/a



Janssen Research& Development, L.L.C.

Curated by ChEMBL


Assay Description
Inverse agonist activity at human cannabinoid receptor 2 expressed in HEK293 cells assessed as increase in forskolin-induced cAMP production preincub...

Bioorg Med Chem Lett 26: 5346-5349 (2016)


Article DOI: 10.1016/j.bmcl.2016.09.025
BindingDB Entry DOI: 10.7270/Q2MC9207
More data for this
Ligand-Target Pair