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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Nociceptin receptor' and Ligand = 'BDBM50185554'   
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))
BDBM50185554
PNG
(2-(2-(2-(3-(4-chlorophenethyl)-1,2,4-oxadiazol-5-y...)
Show SMILES CN(C)CCOCCc1cccc2[nH]c(cc12)-c1nc(CCc2ccc(Cl)cc2)no1
Show InChI InChI=1S/C24H27ClN4O2/c1-29(2)13-15-30-14-12-18-4-3-5-21-20(18)16-22(26-21)24-27-23(28-31-24)11-8-17-6-9-19(25)10-7-17/h3-7,9-10,16,26H,8,11-15H2,1-2H3
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 97n/an/an/an/an/an/a



Banyu Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I][Tyr14]N/OFQ from ORL1 receptor transfected in CHO cells


Bioorg Med Chem Lett 16: 3569-73 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.086
BindingDB Entry DOI: 10.7270/Q2N879D1
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50185554
PNG
(2-(2-(2-(3-(4-chlorophenethyl)-1,2,4-oxadiazol-5-y...)
Show SMILES CN(C)CCOCCc1cccc2[nH]c(cc12)-c1nc(CCc2ccc(Cl)cc2)no1
Show InChI InChI=1S/C24H27ClN4O2/c1-29(2)13-15-30-14-12-18-4-3-5-21-20(18)16-22(26-21)24-27-23(28-31-24)11-8-17-6-9-19(25)10-7-17/h3-7,9-10,16,26H,8,11-15H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 450n/an/an/an/an/an/a



Banyu Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity against ORL1 receptor by GTPgammaS assay


Bioorg Med Chem Lett 16: 3569-73 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.086
BindingDB Entry DOI: 10.7270/Q2N879D1
More data for this
Ligand-Target Pair