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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 = 'BDBM50084239'   
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


(Rattus norvegicus (rat))
BDBM50084239
PNG
(CHEMBL125626 | N,N-Diethyl-4-(morpholin-4-yl-pheny...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C22H28N2O2/c1-3-23(4-2)22(25)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)24-14-16-26-17-15-24/h5-13,21H,3-4,14-17H2,1-2H3
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UniProtKB/SwissProt

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem
PubMed
3.00E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
In vitro radioligand binding assay, for inhibition of [3H]DADLE (Tyr-D-Ala-Gly-Phe-D-Leu) binding to Opioid receptor delta 1, in rat brain membranes ...


J Med Chem 42: 5455-63 (2000)


BindingDB Entry DOI: 10.7270/Q2QJ7J0X
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50084239
PNG
(CHEMBL125626 | N,N-Diethyl-4-(morpholin-4-yl-pheny...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C22H28N2O2/c1-3-23(4-2)22(25)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)24-14-16-26-17-15-24/h5-13,21H,3-4,14-17H2,1-2H3
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CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)


BindingDB Entry DOI: 10.7270/Q2QN661W
More data for this
Ligand-Target Pair