Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM50201585'   

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))	BDBM50201585 ((S)-N-benzyl-3-(2-(2-cyanopyrrolidin-1-yl)-2-oxoet...) Show SMILES CC(C)(CC(=O)NCc1ccccc1)NCC(=O)N1CCC[C@H]1C#N Show InChI InChI=1S/C19H26N4O2/c1-19(2,11-17(24)21-13-15-7-4-3-5-8-15)22-14-18(25)23-10-6-9-16(23)12-20/h3-5,7-8,16,22H,6,9-11,13-14H2,1-2H3,(H,21,24)/t16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	239	n/a	n/a	n/a	n/a	n/a	n/a
National Health Research Institutes Curated by ChEMBL					Assay Description In vitro inhibition of DPP-4				Bioorg Med Chem Lett 17: 1274-9 (2007) Article DOI: 10.1016/j.bmcl.2006.12.019 BindingDB Entry DOI: 10.7270/Q23T9GV7
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