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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 = 'BDBM240328'   
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))
BDBM240328
PNG
(US9409866, 43)
Show SMILES CC(C)(C)C(NC(=O)c1cc(OCC2CC2)c(cn1)C1CC1)c1nccs1
Show InChI InChI=1S/C21H27N3O2S/c1-21(2,3)18(20-22-8-9-27-20)24-19(25)16-10-17(26-12-13-4-5-13)15(11-23-16)14-6-7-14/h8-11,13-14,18H,4-7,12H2,1-3H3,(H,24,25)
PDB

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US Patent
n/an/an/an/a 3.20n/an/an/a37



HOFFMANN-LA ROCHE INC.

US Patent


Assay Description
CHO cells expressing human CB1 or CB2 receptors are seeded 17-24 hours prior to the experiment 50.000 cells per well in a black 96 well plate with fl...


US Patent US9409866 (2016)


BindingDB Entry DOI: 10.7270/Q2FX78BD
More data for this
Ligand-Target Pair