null

SMILES: CC(C)[C@@H]1CC[C@@H](CC1)OC[C@H]1[C@H](CCCN1C(=O)CCc1ccccc1)NS(C)(=O)=O

InChI Key: InChIKey=GYYBDAITWPSUTP-KIHHCIJBSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 386112   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM386112 (N-(cis-2-(((cis-4- isopropylcyclohexyl)oxy)methyl)...) Show SMILES CC(C)[C@@H]1CC[C@@H](CC1)OC[C@H]1[C@H](CCCN1C(=O)CCc1ccccc1)NS(C)(=O)=O |r,wU:3.2,6.9,11.11,12.29,(-6,4.62,;-4.67,5.39,;-4.67,6.93,;-3.33,4.62,;-3.33,3.08,;-2,2.31,;-.67,3.08,;-.67,4.62,;-2,5.39,;.67,2.31,;.67,.77,;2,,;3.33,.77,;4.67,,;4.67,-1.54,;3.33,-2.31,;2,-1.54,;.67,-2.31,;.67,-3.85,;-.67,-1.54,;-2,-2.31,;-2,-3.85,;-3.33,-4.62,;-3.33,-6.16,;-2,-6.93,;-.67,-6.16,;-.67,-4.62,;3.33,2.31,;4.67,3.08,;6,2.31,;3.9,4.41,;5.44,4.41,)| Show InChI InChI=1S/C25H40N2O4S/c1-19(2)21-12-14-22(15-13-21)31-18-24-23(26-32(3,29)30)10-7-17-27(24)25(28)16-11-20-8-5-4-6-9-20/h4-6,8-9,19,21-24,26H,7,10-18H2,1-3H3/t21-,22+,23-,24-/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	4.10E+3	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))	BDBM386112 (N-(cis-2-(((cis-4- isopropylcyclohexyl)oxy)methyl)...) Show SMILES CC(C)[C@@H]1CC[C@@H](CC1)OC[C@H]1[C@H](CCCN1C(=O)CCc1ccccc1)NS(C)(=O)=O |r,wU:3.2,6.9,11.11,12.29,(-6,4.62,;-4.67,5.39,;-4.67,6.93,;-3.33,4.62,;-3.33,3.08,;-2,2.31,;-.67,3.08,;-.67,4.62,;-2,5.39,;.67,2.31,;.67,.77,;2,,;3.33,.77,;4.67,,;4.67,-1.54,;3.33,-2.31,;2,-1.54,;.67,-2.31,;.67,-3.85,;-.67,-1.54,;-2,-2.31,;-2,-3.85,;-3.33,-4.62,;-3.33,-6.16,;-2,-6.93,;-.67,-6.16,;-.67,-4.62,;3.33,2.31,;4.67,3.08,;6,2.31,;3.9,4.41,;5.44,4.41,)| Show InChI InChI=1S/C25H40N2O4S/c1-19(2)21-12-14-22(15-13-21)31-18-24-23(26-32(3,29)30)10-7-17-27(24)25(28)16-11-20-8-5-4-6-9-20/h4-6,8-9,19,21-24,26H,7,10-18H2,1-3H3/t21-,22+,23-,24-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Orexin receptor type 2 (Homo sapiens (Human))	BDBM386112 (N-(cis-2-(((cis-4- isopropylcyclohexyl)oxy)methyl)...) Show SMILES CC(C)[C@@H]1CC[C@@H](CC1)OC[C@H]1[C@H](CCCN1C(=O)CCc1ccccc1)NS(C)(=O)=O |r,wU:3.2,6.9,11.11,12.29,(-6,4.62,;-4.67,5.39,;-4.67,6.93,;-3.33,4.62,;-3.33,3.08,;-2,2.31,;-.67,3.08,;-.67,4.62,;-2,5.39,;.67,2.31,;.67,.77,;2,,;3.33,.77,;4.67,,;4.67,-1.54,;3.33,-2.31,;2,-1.54,;.67,-2.31,;.67,-3.85,;-.67,-1.54,;-2,-2.31,;-2,-3.85,;-3.33,-4.62,;-3.33,-6.16,;-2,-6.93,;-.67,-6.16,;-.67,-4.62,;3.33,2.31,;4.67,3.08,;6,2.31,;3.9,4.41,;5.44,4.41,)| Show InChI InChI=1S/C25H40N2O4S/c1-19(2)21-12-14-22(15-13-21)31-18-24-23(26-32(3,29)30)10-7-17-27(24)25(28)16-11-20-8-5-4-6-9-20/h4-6,8-9,19,21-24,26H,7,10-18H2,1-3H3/t21-,22+,23-,24-/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	4.10E+3	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