Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM386114'   

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))	BDBM386114 (US10287305, Example 55 | US10508083, Example 55 | ...) Show SMILES COC(=O)CCC(=O)N1CCC[C@H](NS(C)(=O)=O)[C@@H]1CO[C@H]1CC[C@H](CC1)C(C)C |r,wU:24.28,21.21,18.19,12.12,(-3.33,-6.54,;-3.33,-5,;-2,-4.23,;-.67,-5,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;3.33,.38,;3.33,1.93,;4.67,2.69,;6,1.93,;3.9,4.03,;5.44,4.03,;2,-.38,;.67,.38,;.67,1.93,;-.67,2.69,;-2,1.93,;-3.33,2.69,;-3.33,4.23,;-2,5,;-.67,4.23,;-4.67,5,;-6,4.23,;-4.67,6.54,)| Show InChI InChI=1S/C21H38N2O6S/c1-15(2)16-7-9-17(10-8-16)29-14-19-18(22-30(4,26)27)6-5-13-23(19)20(24)11-12-21(25)28-3/h15-19,22H,5-14H2,1-4H3/t16-,17+,18-,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	140	n/a	n/a	n/a	n/a
AstraZeneca					Assay Description Chinese hamster ovary (CHO) dhfr-cells forcibly expressing human orexin type 2 receptor (hOX2R) were seeded in each well of Black clear bottom plate ...				J Med Chem 50: 2213-24 (2007) BindingDB Entry DOI: 10.7270/Q2Z321Z2
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM386114 (US10287305, Example 55 | US10508083, Example 55 | ...) Show SMILES COC(=O)CCC(=O)N1CCC[C@H](NS(C)(=O)=O)[C@@H]1CO[C@H]1CC[C@H](CC1)C(C)C |r,wU:24.28,21.21,18.19,12.12,(-3.33,-6.54,;-3.33,-5,;-2,-4.23,;-.67,-5,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;3.33,.38,;3.33,1.93,;4.67,2.69,;6,1.93,;3.9,4.03,;5.44,4.03,;2,-.38,;.67,.38,;.67,1.93,;-.67,2.69,;-2,1.93,;-3.33,2.69,;-3.33,4.23,;-2,5,;-.67,4.23,;-4.67,5,;-6,4.23,;-4.67,6.54,)| Show InChI InChI=1S/C21H38N2O6S/c1-15(2)16-7-9-17(10-8-16)29-14-19-18(22-30(4,26)27)6-5-13-23(19)20(24)11-12-21(25)28-3/h15-19,22H,5-14H2,1-4H3/t16-,17+,18-,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	140	n/a	n/a	n/a	n/a
TBA					Assay Description Chinese hamster ovary (CHO) dhfr-cells forcibly expressing human orexin type 2 receptor (hOX2R) were seeded in each well of Black clear bottom plate ...				Citation and Details BindingDB Entry DOI: 10.7270/Q2CZ3BCW
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM386114 (US10287305, Example 55 | US10508083, Example 55 | ...) Show SMILES COC(=O)CCC(=O)N1CCC[C@H](NS(C)(=O)=O)[C@@H]1CO[C@H]1CC[C@H](CC1)C(C)C |r,wU:24.28,21.21,18.19,12.12,(-3.33,-6.54,;-3.33,-5,;-2,-4.23,;-.67,-5,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;3.33,.38,;3.33,1.93,;4.67,2.69,;6,1.93,;3.9,4.03,;5.44,4.03,;2,-.38,;.67,.38,;.67,1.93,;-.67,2.69,;-2,1.93,;-3.33,2.69,;-3.33,4.23,;-2,5,;-.67,4.23,;-4.67,5,;-6,4.23,;-4.67,6.54,)| Show InChI InChI=1S/C21H38N2O6S/c1-15(2)16-7-9-17(10-8-16)29-14-19-18(22-30(4,26)27)6-5-13-23(19)20(24)11-12-21(25)28-3/h15-19,22H,5-14H2,1-4H3/t16-,17+,18-,19-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	140	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company Limited US Patent					Assay Description Chinese hamster ovary (CHO) dhfr-cells forcibly expressing human orexin type 2 receptor (hOX2R) were seeded in each well of Black clear bottom plate ...				US Patent US10508083 (2019) BindingDB Entry DOI: 10.7270/Q29S1TD1
					More data for this Ligand-Target Pair