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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 = 'BDBM50042902'   
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))
BDBM50042902
PNG
(CHEMBL3354563)
Show SMILES O=C(Nc1nc(ns1)-c1ccccc1)[C@@H]1CCCCN1C(=O)N1CCS(=O)(=O)CC1 |r|
Show InChI InChI=1S/C19H23N5O4S2/c25-17(21-18-20-16(22-29-18)14-6-2-1-3-7-14)15-8-4-5-9-24(15)19(26)23-10-12-30(27,28)13-11-23/h1-3,6-7,15H,4-5,8-13H2,(H,20,21,22,25)/t15-/m0/s1
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Similars

Article
PubMed
n/an/an/an/a 33n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant CB2 receptor expressing CHO cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 3...


Bioorg Med Chem Lett 25: 587-92 (2015)


Article DOI: 10.1016/j.bmcl.2014.12.031
BindingDB Entry DOI: 10.7270/Q2QZ2CM5
More data for this
Ligand-Target Pair