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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50065855'   
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))
BDBM50065855
PNG
(22-cyclopropylmethyl-8-phenyl-14-oxa-11,22-diazahe...)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45C(Oc1c24)c1[nH]c2cc(ccc2c1C[C@@]35O)-c1ccccc1
Show InChI InChI=1S/C32H30N2O3/c35-25-11-9-21-15-26-32(36)16-23-22-10-8-20(19-4-2-1-3-5-19)14-24(22)33-28(23)30-31(32,27(21)29(25)37-30)12-13-34(26)17-18-6-7-18/h1-5,8-11,14,18,26,30,33,35-36H,6-7,12-13,15-17H2/t26-,30?,31+,32-/m1/s1
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Article
PubMed
14n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from morphine-insensitive Opioid receptor delta 1 (presence of 50 nM morphine) of rat brain membranes


J Med Chem 41: 2872-81 (1998)


Article DOI: 10.1021/jm980083i
BindingDB Entry DOI: 10.7270/Q24F1RFN
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50065855
PNG
(22-cyclopropylmethyl-8-phenyl-14-oxa-11,22-diazahe...)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45C(Oc1c24)c1[nH]c2cc(ccc2c1C[C@@]35O)-c1ccccc1
Show InChI InChI=1S/C32H30N2O3/c35-25-11-9-21-15-26-32(36)16-23-22-10-8-20(19-4-2-1-3-5-19)14-24(22)33-28(23)30-31(32,27(21)29(25)37-30)12-13-34(26)17-18-6-7-18/h1-5,8-11,14,18,26,30,33,35-36H,6-7,12-13,15-17H2/t26-,30?,31+,32-/m1/s1
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18n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from Opioid receptor delta 1 of rat brain membranes (DAMGO quenching mu receptor)


J Med Chem 41: 2872-81 (1998)


Article DOI: 10.1021/jm980083i
BindingDB Entry DOI: 10.7270/Q24F1RFN
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50065855
PNG
(22-cyclopropylmethyl-8-phenyl-14-oxa-11,22-diazahe...)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45C(Oc1c24)c1[nH]c2cc(ccc2c1C[C@@]35O)-c1ccccc1
Show InChI InChI=1S/C32H30N2O3/c35-25-11-9-21-15-26-32(36)16-23-22-10-8-20(19-4-2-1-3-5-19)14-24(22)33-28(23)30-31(32,27(21)29(25)37-30)12-13-34(26)17-18-6-7-18/h1-5,8-11,14,18,26,30,33,35-36H,6-7,12-13,15-17H2/t26-,30?,31+,32-/m1/s1
PDB

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PC sid
UniChem

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Article
PubMed
299n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from morphine-sensitive Opioid receptor delta 1 (presence of 300 nM DELT-II) of rat brain membranes


J Med Chem 41: 2872-81 (1998)


Article DOI: 10.1021/jm980083i
BindingDB Entry DOI: 10.7270/Q24F1RFN
More data for this
Ligand-Target Pair