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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Nociceptin receptor' and Ligand = 'BDBM50409822'   
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))
BDBM50409822
PNG
(CHEMBL2111608)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m0/s1
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PC cid
PC sid
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Similars

Article
PubMed
28n/an/an/an/an/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Binding affinity against human Nociceptin receptor on CHO cell membranes by [3H]N/OFQ displacement.


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
BindingDB Entry DOI: 10.7270/Q2KW5FHV
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50409822
PNG
(CHEMBL2111608)
Show SMILES O=C1Cc2ccccc2N1C1CCN(C[C@@H]2CC3CCC2C3)CC1 |r,THB:14:15:21:19.18|
Show InChI InChI=1S/C21H28N2O/c24-21-13-17-3-1-2-4-20(17)23(21)19-7-9-22(10-8-19)14-18-12-15-5-6-16(18)11-15/h1-4,15-16,18-19H,5-14H2/t15?,16?,18-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



SRI International

Curated by ChEMBL


Assay Description
Concentration required for stimulation of [35S]-GTP-gammaS, binding to human Nociceptin receptor in cell membranes


J Med Chem 47: 2973-6 (2004)


Article DOI: 10.1021/jm034249d
BindingDB Entry DOI: 10.7270/Q2KW5FHV
More data for this
Ligand-Target Pair