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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM50258743'   
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
Orexin receptor type 2


(Homo sapiens (Human))
BDBM50258743
PNG
(CHEMBL511604 | cyclohexyl(4-(quinazolin-2-yl)-1,4-...)
Show SMILES O=C(C1CCCCC1)N1CCCN(CC1)c1ncc2ccccc2n1
Show InChI InChI=1S/C20H26N4O/c25-19(16-7-2-1-3-8-16)23-11-6-12-24(14-13-23)20-21-15-17-9-4-5-10-18(17)22-20/h4-5,9-10,15-16H,1-3,6-8,11-14H2
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PC cid
PC sid
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Article
PubMed
550n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to OX2 receptor (unknown origin)


Bioorg Med Chem Lett 19: 2997-3001 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.026
BindingDB Entry DOI: 10.7270/Q22J6BR1
More data for this
Ligand-Target Pair