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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 = 'BDBM50148070'   
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))
BDBM50148070
PNG
(3-butoxy-17-cyclopropylmethyl-10-methoxy-(1R,9R,10...)
Show SMILES CCCCOc1cccc2C[C@H]3N(CC4CC4)CCC4(CC(=O)CC[C@@]34OC)c12 |TLB:13:12:25:28.9.10|
Show InChI InChI=1S/C25H35NO3/c1-3-4-14-29-21-7-5-6-19-15-22-25(28-2)11-10-20(27)16-24(25,23(19)21)12-13-26(22)17-18-8-9-18/h5-7,18,22H,3-4,8-17H2,1-2H3/t22-,24?,25-/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
7.65E+5n/an/an/an/an/an/an/an/a



University of Innsbruck

Curated by ChEMBL


Assay Description
Binding affinity determined by displacing [3H][Ile5,6]deltorphin II from opioid receptor delta 1 in rat brain membranes


J Med Chem 47: 3242-7 (2004)


Article DOI: 10.1021/jm031126k
BindingDB Entry DOI: 10.7270/Q2TD9WT4
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50148070
PNG
(3-butoxy-17-cyclopropylmethyl-10-methoxy-(1R,9R,10...)
Show SMILES CCCCOc1cccc2C[C@H]3N(CC4CC4)CCC4(CC(=O)CC[C@@]34OC)c12 |TLB:13:12:25:28.9.10|
Show InChI InChI=1S/C25H35NO3/c1-3-4-14-29-21-7-5-6-19-15-22-25(28-2)11-10-20(27)16-24(25,23(19)21)12-13-26(22)17-18-8-9-18/h5-7,18,22H,3-4,8-17H2,1-2H3/t22-,24?,25-/m1/s1
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UniProtKB/SwissProt

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antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.61E+3n/an/an/an/a



University of Innsbruck

Curated by ChEMBL


Assay Description
Concentration necessary to produce 50% of the Emax value, i.e. to stimulate [35S]GTP-gamma-S, binding to recombinant human opioid receptor delta 1 ex...


J Med Chem 47: 3242-7 (2004)


Article DOI: 10.1021/jm031126k
BindingDB Entry DOI: 10.7270/Q2TD9WT4
More data for this
Ligand-Target Pair