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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 = 'BDBM50267637'   
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


(Rattus norvegicus (Rat))
BDBM50267637
PNG
(11-(3,5-Dihydroxyphenoxy)undecanoic Acid (2-Hydrox...)
Show SMILES OCCNC(=O)CCCCCCCCCCOc1cc(O)cc(O)c1
Show InChI InChI=1S/C19H31NO5/c21-11-10-20-19(24)9-7-5-3-1-2-4-6-8-12-25-18-14-16(22)13-17(23)15-18/h13-15,21-23H,1-12H2,(H,20,24)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

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



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to CB2 receptor in rat spleen membrane


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50267637
PNG
(11-(3,5-Dihydroxyphenoxy)undecanoic Acid (2-Hydrox...)
Show SMILES OCCNC(=O)CCCCCCCCCCOc1cc(O)cc(O)c1
Show InChI InChI=1S/C19H31NO5/c21-11-10-20-19(24)9-7-5-3-1-2-4-6-8-12-25-18-14-16(22)13-17(23)15-18/h13-15,21-23H,1-12H2,(H,20,24)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

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



Universita degli Studi di Siena

Curated by ChEMBL


Assay Description
Binding affinity to CB2 receptor in rat brain membrane


J Med Chem 52: 2506-14 (2009)


Article DOI: 10.1021/jm8016255
BindingDB Entry DOI: 10.7270/Q2X34XCN
More data for this
Ligand-Target Pair