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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1' and Ligand = 'BDBM50013857'   
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/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1


(Rattus norvegicus (rat)-RAT)
BDBM50013857
PNG
(14-[4-diazo(methyl)anilino]-4-cyclopropylmethyl-12...)
Show SMILES CN(C1CCC2(O)C3Cc4ccc(O)c5OC1C2(CCN3CC1CC1)c45)c1ccc(cc1)[N+]#N |TLB:14:25:5:20.18.19,10:9:5:20.18.19,THB:4:5:25.9.8:20.18.19|
Show InChI InChI=1S/C27H30N4O3/c1-30(19-7-5-18(29-28)6-8-19)20-10-11-27(33)22-14-17-4-9-21(32)24-23(17)26(27,25(20)34-24)12-13-31(22)15-16-2-3-16/h4-9,16,20,22,25,33H,2-3,10-15H2,1H3/p+1
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MMDB

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PC cid
PC sid
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Similars

PubMed
1.70n/an/an/an/an/an/an/an/a



Universit£ Louis Pasteur

Curated by ChEMBL


Assay Description
Inhibition of [3H]diprenorphine binding to rat brain membrane opioid receptors;(T= total opioid receptor family)


J Med Chem 33: 2456-64 (1990)


BindingDB Entry DOI: 10.7270/Q21Z451M
More data for this
Ligand-Target Pair