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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'N-arachidonyl glycine receptor' and Ligand = 'BDBM50449565'   
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
N-arachidonyl glycine receptor


(Homo sapiens (Human))
BDBM50449565
PNG
(CHEMBL4177155)
Show SMILES Clc1ccc(COc2cccc(\C=C3/N=C(NC3=O)SCCc3ccccc3)c2)cc1 |c:14|
Show InChI InChI=1S/C25H21ClN2O2S/c26-21-11-9-19(10-12-21)17-30-22-8-4-7-20(15-22)16-23-24(29)28-25(27-23)31-14-13-18-5-2-1-3-6-18/h1-12,15-16H,13-14,17H2,(H,27,28,29)/b23-16-
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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.78E+3n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant human GPR18 expressed in CHO cells assessed as inhibition of delta9-THC-induced beta-arrestin recruitment preincub...


Eur J Med Chem 155: 381-397 (2018)


Article DOI: 10.1016/j.ejmech.2018.05.050
BindingDB Entry DOI: 10.7270/Q22F7R1X
More data for this
Ligand-Target Pair
N-arachidonyl glycine receptor


(Homo sapiens (Human))
BDBM50449565
PNG
(CHEMBL4177155)
Show SMILES Clc1ccc(COc2cccc(\C=C3/N=C(NC3=O)SCCc3ccccc3)c2)cc1 |c:14|
Show InChI InChI=1S/C25H21ClN2O2S/c26-21-11-9-19(10-12-21)17-30-22-8-4-7-20(15-22)16-23-24(29)28-25(27-23)31-14-13-18-5-2-1-3-6-18/h1-12,15-16H,13-14,17H2,(H,27,28,29)/b23-16-
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at recombinant human GPR18 expressed in CHO cells assessed as increase in beta-arrestin recruitment incubated for 60 mins measured f...


Eur J Med Chem 155: 381-397 (2018)


Article DOI: 10.1016/j.ejmech.2018.05.050
BindingDB Entry DOI: 10.7270/Q22F7R1X
More data for this
Ligand-Target Pair