Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM559673'   

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))	BDBM559673 (WO2022109117, Example 18) Show SMILES C[C@@H]1C[C@H](NS(=O)(=O)N(C)C)[C@@H]2CO[C@H]3CC[C@H](CC3)c3cccc(OCCCOC(=O)N12)c3 |wD:3.3,14.14,17.16,11.34,1.0,(17.24,6.51,;16.73,5.07,;17.59,3.82,;16.67,2.61,;17.1,1.15,;18.58,.8,;18.94,2.28,;18.23,-.68,;20.06,.45,;20.5,-1.01,;21.11,1.55,;15.23,3.12,;14.63,1.66,;13.48,.58,;11.93,.3,;11.66,1.81,;10.25,2.36,;8.98,1.46,;9.27,-.08,;10.7,-.66,;7.77,2.55,;6.21,2.47,;5.3,3.7,;5.95,5.09,;7.48,5.29,;8.19,6.69,;9.33,7.73,;10.8,8.17,;12.34,8.03,;13.72,7.33,;14.75,6.16,;16.07,6.92,;15.27,4.64,;8.33,4.01,)| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	WIPO WO2022109117	n/a	n/a	0.140	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
					More data for this Ligand-Target Pair