Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM559747'   

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))	BDBM559747 (WO2022109117, Example 92) Show SMILES C[C@@H]1C[C@H](NS(C)(=O)=O)[C@@H]2COC3CCC(CC3)c3ccc(F)c(NCCOC(=O)N12)n3 |wD:1.0,3.3,9.32,(16.35,5.9,;15.98,4.43,;16.95,3.26,;16.14,1.97,;16.7,.56,;18.21,.35,;19.71,.13,;18.42,1.85,;17.99,-1.16,;14.66,2.35,;14.18,.85,;13.14,-.39,;11.53,-.71,;10.2,-1.55,;8.77,-.97,;8.56,.59,;9.86,1.43,;11.23,.79,;7.45,1.78,;5.89,1.87,;5.17,3.22,;5.91,4.54,;5.16,5.86,;7.46,4.5,;8.34,5.77,;9.64,6.6,;11.18,6.77,;12.66,6.31,;13.86,5.3,;15.05,6.23,;14.56,3.86,;8.19,3.14,)| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	WIPO WO2022109117	n/a	n/a	0.130	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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