Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM50256440'   

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
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50256440 ((R)-3-amino-1-(4-benzyl-1,4-diazepan-1-yl)-4-(2,4,...) Show SMILES N[C@@H](CC(=O)N1CCCN(Cc2ccccc2)CC1)Cc1cc(F)c(F)cc1F |r| Show InChI InChI=1S/C22H26F3N3O/c23-19-14-21(25)20(24)12-17(19)11-18(26)13-22(29)28-8-4-7-27(9-10-28)15-16-5-2-1-3-6-16/h1-3,5-6,12,14,18H,4,7-11,13,15,26H2/t18-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	387	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Chemical Technology Curated by ChEMBL					Assay Description Inhibition of DPP4 (unknown origin)				Bioorg Med Chem Lett 18: 6525-9 (2008) Article DOI: 10.1016/j.bmcl.2008.10.076 BindingDB Entry DOI: 10.7270/Q25D8RQV
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