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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nociceptin receptor' and Ligand = 'BDBM469378'   
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))		BDBM469378
PNG
(US10807988, Example SC_3024 | cis-5-[8-Dimethylami...)
Show SMILES CC(C)CN1C(=O)N(C[C@]11CC[C@@](CC1)(N(C)C)c1ccccc1)c1cnc(nc1)C#N |r,wU:9.9,12.16,(.13,-25.61,;-.34,-24.14,;-1.85,-23.82,;.69,-23,;.21,-21.53,;-1.25,-21.06,;-2.5,-21.96,;-1.25,-19.52,;.21,-19.04,;1.12,-20.29,;1.89,-21.62,;3.43,-21.62,;4.2,-20.29,;3.43,-18.95,;1.89,-18.95,;4.97,-18.95,;4.2,-17.62,;6.51,-18.95,;4.97,-21.62,;4.2,-22.95,;4.97,-24.29,;6.51,-24.29,;7.28,-22.95,;6.51,-21.62,;-2.5,-18.61,;-2.34,-17.08,;-3.58,-16.18,;-4.99,-16.8,;-5.15,-18.33,;-3.91,-19.24,;-6.24,-15.9,;-7.48,-14.99,)|
Show InChI InChI=1S/C25H32N6O/c1-19(2)17-31-23(32)30(21-15-27-22(14-26)28-16-21)18-24(31)10-12-25(13-11-24,29(3)4)20-8-6-5-7-9-20/h5-9,15-16,19H,10-13,17-18H2,1-4H3/t24-,25+
PDB

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US Patent
 1n/an/an/an/an/an/an/an/a



Grünenthal GmbH

US Patent


Assay Description
The hNOP receptor binding assay was performed as homogeneous SPA-assay (scintillation proximity assay) using the assay buffer 50 mM TRIS-HCl. 10 mM M...

US Patent US10807988 (2020)


BindingDB Entry DOI: 10.7270/Q25Q5060
More data for this
Ligand-Target Pair