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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 = 'BDBM176612'   
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))
BDBM176612
PNG
(US9115121, 3)
Show SMILES COc1ccc(cc1OC)-c1nc(NCCc2ccc(F)cc2)nc(OC)n1
Show InChI InChI=1S/C20H21FN4O3/c1-26-16-9-6-14(12-17(16)27-2)18-23-19(25-20(24-18)28-3)22-11-10-13-4-7-15(21)8-5-13/h4-9,12H,10-11H2,1-3H3,(H,22,23,24,25)
PDB

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PC cid
PC sid
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US Patent
n/an/a 11n/an/an/an/an/an/a



Sanofi

US Patent


Assay Description
Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...


US Patent US9115121 (2015)


BindingDB Entry DOI: 10.7270/Q23N225X
More data for this
Ligand-Target Pair