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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nociceptin receptor' and Ligand = 'BDBM50100994'   
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))
BDBM50100994
PNG
(CHEMBL3325882)
Show SMILES CN(C)[C@]1(CC[C@H](N)CC1)c1ccccc1 |r,wU:3.2,wD:6.6,(17.62,-17.1,;16.29,-16.33,;16.28,-14.79,;14.95,-17.11,;14.18,-18.44,;12.64,-18.44,;11.87,-17.11,;10.33,-17.11,;12.63,-15.78,;14.18,-15.78,;15.75,-18.43,;15,-19.77,;15.8,-21.09,;17.34,-21.06,;18.09,-19.7,;17.29,-18.39,)|
Show InChI InChI=1S/C14H22N2/c1-16(2)14(10-8-13(15)9-11-14)12-6-4-3-5-7-12/h3-7,13H,8-11,15H2,1-2H3/t13-,14-
PDB

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PC cid
PC sid
UniChem
Article
PubMed
120n/an/an/an/an/an/an/an/a



Pharmacokinetics

Curated by ChEMBL


Assay Description
Displacement of [3H]nociceptin from human NOP receptor expressed in CHO-K1 cells after 90 mins


ACS Med Chem Lett 5: 851-6 (2014)


Article DOI: 10.1021/ml500116x
BindingDB Entry DOI: 10.7270/Q28S4RPM
More data for this
Ligand-Target Pair