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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM111130'   
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 1


(Homo sapiens (Human))
BDBM111130
PNG
(US9682940, 23)
Show SMILES NS(=O)(=O)N1CCC(CC1)c1n[nH]c2ccc(cc12)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H24Cl2N4O2S/c26-20-6-1-16(2-7-20)24(17-3-8-21(27)9-4-17)19-5-10-23-22(15-19)25(30-29-23)18-11-13-31(14-12-18)34(28,32)33/h1-10,15,18,24H,11-14H2,(H,29,30)(H2,28,32,33)
PDB

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PC cid
PC sid
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US Patent
n/an/an/an/a 2.15E+3n/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
CB1 and CB2 receptors are Gi-coupled GPCR. Activation of CB1 and CB2 receptors results in a decrease in cAMP production. An inverse agonist of the CB...


US Patent US9682940 (2017)


BindingDB Entry DOI: 10.7270/Q2M61HD7
More data for this
Ligand-Target Pair