Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM50226084'   

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))	BDBM50226084 ((S)-1-((3R,4R)-1-(3-cyano-4-fluorobenzyl)-3-aminop...) Show SMILES N[C@H]1CN(Cc2ccc(F)c(c2)C#N)C[C@H]1C(=O)N1CCC[C@H]1C#N Show InChI InChI=1S/C18H20FN5O/c19-16-4-3-12(6-13(16)7-20)9-23-10-15(17(22)11-23)18(25)24-5-1-2-14(24)8-21/h3-4,6,14-15,17H,1-2,5,9-11,22H2/t14-,15+,17-/m0/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	3.60	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of human DPP4				Bioorg Med Chem Lett 17: 6707-13 (2007) Article DOI: 10.1016/j.bmcl.2007.10.063 BindingDB Entry DOI: 10.7270/Q2ZS2W8B
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