Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM119577'   

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))	BDBM119577 (US8680275, 134) Show SMILES COc1ccc(c(c1)C(=O)N1CC[C@H]2CN([C@H]2C1)c1nc(C)cc(C)n1)-n1nccn1 |r| Show InChI InChI=1S/C22H25N7O2/c1-14-10-15(2)26-22(25-14)28-12-16-6-9-27(13-20(16)28)21(30)18-11-17(31-3)4-5-19(18)29-23-7-8-24-29/h4-5,7-8,10-11,16,20H,6,9,12-13H2,1-3H3/t16-,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	16	-41.4	n/a	n/a	n/a	n/a	n/a	n/a	4
Janssen Pharmaceutica NV US Patent					Assay Description HEK293 stably expressing human orexin-2 receptor (Genebank accession number NM 001526) were grown to confluency in DMEM/F12 (Gibco, Cat #11039), in D...				US Patent US8680275 (2014) BindingDB Entry DOI: 10.7270/Q2WH2NPF
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