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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 = 'BDBM50072997'   
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))
BDBM50072997
PNG
(CHEMBL3410823)
Show SMILES CCCCCOc1c(OC)ccc2c1ccn(CCc1ccncc1)c2=O
Show InChI InChI=1S/C22H26N2O3/c1-3-4-5-16-27-21-18-11-15-24(14-10-17-8-12-23-13-9-17)22(25)19(18)6-7-20(21)26-2/h6-9,11-13,15H,3-5,10,14,16H2,1-2H3
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PC cid
PC sid
UniChem

Similars

Article
PubMed
8.40n/an/an/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Binding affinity to CB2 receptor (unknown origin)


Eur J Med Chem 93: 16-32 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.054
BindingDB Entry DOI: 10.7270/Q28P626S
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50072997
PNG
(CHEMBL3410823)
Show SMILES CCCCCOc1c(OC)ccc2c1ccn(CCc1ccncc1)c2=O
Show InChI InChI=1S/C22H26N2O3/c1-3-4-5-16-27-21-18-11-15-24(14-10-17-8-12-23-13-9-17)22(25)19(18)6-7-20(21)26-2/h6-9,11-13,15H,3-5,10,14,16H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
8.40n/an/an/an/an/an/an/an/a



Zhejiang University

Curated by ChEMBL


Assay Description
Binding affinity to CB2 receptor (unknown origin)


Eur J Med Chem 93: 16-32 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.054
BindingDB Entry DOI: 10.7270/Q28P626S
More data for this
Ligand-Target Pair