Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM386070'   

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))	BDBM386070 (N-((2R,3S)-2-(((cis-4-(2,5- difluorophenyl)cyclohe...) Show SMILES CS(=O)(=O)N[C@H]1CCCN[C@H]1CO[C@H]1CC[C@H](CC1)c1cc(F)ccc1F |r,wU:16.20,13.13,10.11,5.4,(7.34,-.39,;6,.38,;5.23,1.72,;6.77,1.72,;4.67,-.39,;4.67,-1.93,;6,-2.7,;6,-4.24,;4.67,-5.01,;3.33,-4.24,;3.33,-2.7,;2,-1.93,;2,-.39,;.67,.38,;-.67,-.39,;-2,.38,;-2,1.92,;-.67,2.69,;.67,1.92,;-3.33,2.69,;-4.67,1.92,;-6,2.69,;-7.34,1.92,;-6,4.23,;-4.67,5.01,;-3.33,4.23,;-2,5,)| Show InChI InChI=1S/C19H28F2N2O3S/c1-27(24,25)23-18-3-2-10-22-19(18)12-26-15-7-4-13(5-8-15)16-11-14(20)6-9-17(16)21/h6,9,11,13,15,18-19,22-23H,2-5,7-8,10,12H2,1H3/t13-,15+,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	220	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))	BDBM386070 (N-((2R,3S)-2-(((cis-4-(2,5- difluorophenyl)cyclohe...) Show SMILES CS(=O)(=O)N[C@H]1CCCN[C@H]1CO[C@H]1CC[C@H](CC1)c1cc(F)ccc1F |r,wU:16.20,13.13,10.11,5.4,(7.34,-.39,;6,.38,;5.23,1.72,;6.77,1.72,;4.67,-.39,;4.67,-1.93,;6,-2.7,;6,-4.24,;4.67,-5.01,;3.33,-4.24,;3.33,-2.7,;2,-1.93,;2,-.39,;.67,.38,;-.67,-.39,;-2,.38,;-2,1.92,;-.67,2.69,;.67,1.92,;-3.33,2.69,;-4.67,1.92,;-6,2.69,;-7.34,1.92,;-6,4.23,;-4.67,5.01,;-3.33,4.23,;-2,5,)| Show InChI InChI=1S/C19H28F2N2O3S/c1-27(24,25)23-18-3-2-10-22-19(18)12-26-15-7-4-13(5-8-15)16-11-14(20)6-9-17(16)21/h6,9,11,13,15,18-19,22-23H,2-5,7-8,10,12H2,1H3/t13-,15+,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	220	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))	BDBM386070 (N-((2R,3S)-2-(((cis-4-(2,5- difluorophenyl)cyclohe...) Show SMILES CS(=O)(=O)N[C@H]1CCCN[C@H]1CO[C@H]1CC[C@H](CC1)c1cc(F)ccc1F |r,wU:16.20,13.13,10.11,5.4,(7.34,-.39,;6,.38,;5.23,1.72,;6.77,1.72,;4.67,-.39,;4.67,-1.93,;6,-2.7,;6,-4.24,;4.67,-5.01,;3.33,-4.24,;3.33,-2.7,;2,-1.93,;2,-.39,;.67,.38,;-.67,-.39,;-2,.38,;-2,1.92,;-.67,2.69,;.67,1.92,;-3.33,2.69,;-4.67,1.92,;-6,2.69,;-7.34,1.92,;-6,4.23,;-4.67,5.01,;-3.33,4.23,;-2,5,)| Show InChI InChI=1S/C19H28F2N2O3S/c1-27(24,25)23-18-3-2-10-22-19(18)12-26-15-7-4-13(5-8-15)16-11-14(20)6-9-17(16)21/h6,9,11,13,15,18-19,22-23H,2-5,7-8,10,12H2,1H3/t13-,15+,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	220	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