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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50332254'   
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))
BDBM50332254
PNG
((E)-7-Naphthalen-2-yl-5-oxohept-6-enoic piperidina...)
Show SMILES O=C(CCCC(=O)N1CCCCC1)C=Cc1ccc2ccccc2c1 |w:14.15|
Show InChI InChI=1S/C22H25NO2/c24-21(9-6-10-22(25)23-15-4-1-5-16-23)14-12-18-11-13-19-7-2-3-8-20(19)17-18/h2-3,7-8,11-14,17H,1,4-6,9-10,15-16H2
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PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells


Bioorg Med Chem 18: 8463-77 (2010)


Article DOI: 10.1016/j.bmc.2010.10.050
BindingDB Entry DOI: 10.7270/Q2319W4V
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50332254
PNG
((E)-7-Naphthalen-2-yl-5-oxohept-6-enoic piperidina...)
Show SMILES O=C(CCCC(=O)N1CCCCC1)C=Cc1ccc2ccccc2c1 |w:14.15|
Show InChI InChI=1S/C22H25NO2/c24-21(9-6-10-22(25)23-15-4-1-5-16-23)14-12-18-11-13-19-7-2-3-8-20(19)17-18/h2-3,7-8,11-14,17H,1,4-6,9-10,15-16H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells


Bioorg Med Chem 18: 8463-77 (2010)


Article DOI: 10.1016/j.bmc.2010.10.050
BindingDB Entry DOI: 10.7270/Q2319W4V
More data for this
Ligand-Target Pair