Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 2' and Ligand = 'BDBM50221446'   

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 2 (Homo sapiens (Human))	BDBM50221446 ((R)-3-amino-1-((R)-8-(cyclopropyl(hydroxy)methyl)-...) Show SMILES NC(CC(=O)N1CCn2nc(nc2[C@@H]1C(O)C1CC1)C(F)(F)F)Cc1cc(F)c(F)cc1F |w:1.0,14.16| Show InChI InChI=1S/C20H21F6N5O2/c21-12-8-14(23)13(22)6-10(12)5-11(27)7-15(32)30-3-4-31-18(16(30)17(33)9-1-2-9)28-19(29-31)20(24,25)26/h6,8-9,11,16-17,33H,1-5,7,27H2/t11?,16-,17?/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of QPP				Bioorg Med Chem Lett 17: 5934-9 (2007) Article DOI: 10.1016/j.bmcl.2007.07.100 BindingDB Entry DOI: 10.7270/Q20C4VH0
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