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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50125438'   
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
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50125438
PNG
(1-[2-(3-Hydroxy-pyrrolidin-1-yl)-1-phenyl-ethyl]-3...)
Show SMILES OC1CCN(CC(c2ccccc2)n2cccc(-c3ccccc3)c2=O)C1
Show InChI InChI=1S/C23H24N2O2/c26-20-13-15-24(16-20)17-22(19-10-5-2-6-11-19)25-14-7-12-21(23(25)27)18-8-3-1-4-9-18/h1-12,14,20,22,26H,13,15-17H2
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KEGG

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PC cid
PC sid
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Similars

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



AstraZeneca R&D

Curated by ChEMBL


Assay Description
Inhibition of [125I]-Enkephalin binding to human mu opioid receptor from membranes of HEK293 cells


Bioorg Med Chem Lett 13: 1141-5 (2003)


BindingDB Entry DOI: 10.7270/Q24J0DH2
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50125438
PNG
(1-[2-(3-Hydroxy-pyrrolidin-1-yl)-1-phenyl-ethyl]-3...)
Show SMILES OC1CCN(CC(c2ccccc2)n2cccc(-c3ccccc3)c2=O)C1
Show InChI InChI=1S/C23H24N2O2/c26-20-13-15-24(16-20)17-22(19-10-5-2-6-11-19)25-14-7-12-21(23(25)27)18-8-3-1-4-9-18/h1-12,14,20,22,26H,13,15-17H2
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



AstraZeneca R&D

Curated by ChEMBL


Assay Description
Inhibition of [125I]-Deltorphin binding to human delta opioid receptor from membranes of HEK293 cells


Bioorg Med Chem Lett 13: 1141-5 (2003)


BindingDB Entry DOI: 10.7270/Q24J0DH2
More data for this
Ligand-Target Pair