Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 8' and Ligand = 'BDBM50201596'   

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 8 (Homo sapiens (Human))	BDBM50201596 ((S)-3-(2-(2-cyanopyrrolidin-1-yl)-2-oxoethylamino)...) Show SMILES Cc1ccc(CCNC(=O)CC(C)(C)NCC(=O)N2CCC[C@H]2C#N)cc1 Show InChI InChI=1S/C21H30N4O2/c1-16-6-8-17(9-7-16)10-11-23-19(26)13-21(2,3)24-15-20(27)25-12-4-5-18(25)14-22/h6-9,18,24H,4-5,10-13,15H2,1-3H3,(H,23,26)/t18-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	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-8				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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