Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM559659'   

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))	BDBM559659 (WO2022109117, Example 4) Show SMILES C[C@@H]1C[C@H](NS(=O)(=O)N(C)C)[C@@H]2CO[C@H]3CC[C@H](CC3)c3ccccc3CCOC(=O)N12 |wU:3.3,14.19,17.17,11.34,1.0,(7.84,-2.1,;6.55,-1.27,;6.46,.27,;4.97,.66,;4.41,2.09,;5.37,3.29,;6.57,2.33,;4.17,4.26,;6.33,4.5,;5.77,5.93,;7.86,4.26,;4.14,-.64,;2.72,.03,;1.13,.06,;-.2,-.85,;.94,-1.91,;.69,-3.42,;-.71,-4.05,;-1.86,-2.99,;-1.66,-1.45,;-.07,-5.54,;-1.54,-6.01,;-1.86,-7.52,;-.72,-8.55,;.75,-8.08,;1.07,-6.57,;2.72,-6.8,;4.2,-6.14,;5.18,-4.87,;5.49,-3.35,;7.03,-3.32,;5.11,-1.83,)| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	WIPO WO2022109117	n/a	n/a	0.370	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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