Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM559711'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Orexin receptor type 2 (Homo sapiens (Human))	BDBM559711 (WO2022109117, Example 56) Show SMILES C[C@@H]1C[C@H](NS(C)(=O)=O)[C@@H]2COC3CCC(CC3)c3ccc(F)c(OCCOC(=O)N12)n3 |wD:1.0,3.3,9.32,(-.41,-5.44,;-.04,-3.96,;-1.01,-2.8,;-.2,-1.51,;-.76,-.1,;-2.27,.12,;-3.77,.33,;-2.49,-1.39,;-2.05,1.62,;1.27,-1.88,;1.76,-.38,;2.79,.85,;4.41,1.17,;5.74,2.01,;7.17,1.43,;7.37,-.13,;6.08,-.96,;4.71,-.33,;8.48,-1.32,;10.05,-1.41,;10.76,-2.76,;10.03,-4.08,;10.78,-5.4,;8.47,-4.04,;7.6,-5.31,;6.3,-6.14,;4.76,-6.31,;3.28,-5.85,;2.08,-4.84,;.88,-5.77,;1.37,-3.4,;7.75,-2.68,)| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	WIPO WO2022109117	n/a	n/a	0.110	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description In a typical experiment, the OXI and OX2 receptor agonist activity is determined in accordance with the following general experimental method. Chines...				Citation and Details BindingDB Entry DOI: 10.7270/Q2C53Q2G
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