Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM559665'   

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))	BDBM559665 (WO2022109117, Example 10) Show SMILES C[C@@H]1C[C@H](NS(=O)(=O)N(C)C)[C@@H]2CO[C@H]3CC[C@H](CC3)c3cccc(OCCCCC(=O)N12)c3 |wD:1.0,3.3,14.14,17.16,11.34,(17.39,6.55,;16.89,5.11,;17.75,3.86,;16.83,2.66,;17.26,1.2,;18.74,.85,;19.09,2.33,;18.39,-.63,;20.22,.5,;20.65,-.96,;21.26,1.6,;15.4,3.16,;14.79,1.71,;13.64,.63,;12.09,.34,;11.83,1.86,;10.41,2.4,;9.15,1.51,;9.44,-.03,;10.86,-.61,;7.94,2.6,;6.38,2.52,;5.47,3.74,;6.12,5.13,;7.65,5.33,;8.36,6.73,;9.5,7.77,;10.97,8.21,;12.51,8.07,;13.89,7.37,;14.91,6.2,;16.23,6.96,;15.43,4.68,;8.5,4.05,)| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	WIPO WO2022109117	n/a	n/a	0.300	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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