Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Orexin receptor type 2' and Ligand = 'BDBM50258742'   

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))	BDBM50258742 ((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(4-(naph...) Show SMILES Cc1ccc(c(c1)C(=O)N1CCCN(CC1)c1ccc2ccccc2c1)-n1nccn1 Show InChI InChI=1S/C25H25N5O/c1-19-7-10-24(30-26-11-12-27-30)23(17-19)25(31)29-14-4-13-28(15-16-29)22-9-8-20-5-2-3-6-21(20)18-22/h2-3,5-12,17-18H,4,13-16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to OX2 receptor (unknown origin)				Bioorg Med Chem Lett 19: 2997-3001 (2009) Article DOI: 10.1016/j.bmcl.2009.04.026 BindingDB Entry DOI: 10.7270/Q22J6BR1
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