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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Nociceptin receptor' and Ligand = 'BDBM50259147'   
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
Nociceptin receptor


(Homo sapiens (Human))
BDBM50259147
PNG
(8-(bis(2-chlorophenyl)methyl)-3-methoxy-3-phenyl-8...)
Show SMILES COC1(CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl)c1ccccc1 |TLB:1:2:9:5.6|
Show InChI InChI=1S/C27H27Cl2NO/c1-31-27(19-9-3-2-4-10-19)17-20-15-16-21(18-27)30(20)26(22-11-5-7-13-24(22)28)23-12-6-8-14-25(23)29/h2-14,20-21,26H,15-18H2,1H3
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Article
PubMed
8n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I][Tyr14]nociceptin from human cloned NOP receptor expressed in CHO cells


Bioorg Med Chem Lett 19: 2519-23 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.031
BindingDB Entry DOI: 10.7270/Q20V8CPS
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50259147
PNG
(8-(bis(2-chlorophenyl)methyl)-3-methoxy-3-phenyl-8...)
Show SMILES COC1(CC2CCC(C1)N2C(c1ccccc1Cl)c1ccccc1Cl)c1ccccc1 |TLB:1:2:9:5.6|
Show InChI InChI=1S/C27H27Cl2NO/c1-31-27(19-9-3-2-4-10-19)17-20-15-16-21(18-27)30(20)26(22-11-5-7-13-24(22)28)23-12-6-8-14-25(23)29/h2-14,20-21,26H,15-18H2,1H3
PDB

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antibodypedia
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PC sid
UniChem

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Article
PubMed
n/an/an/an/a 50n/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at human NOP assessed as stimulation of GDP-induced [35S]GTPgammaS binding


Bioorg Med Chem Lett 19: 2519-23 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.031
BindingDB Entry DOI: 10.7270/Q20V8CPS
More data for this
Ligand-Target Pair