Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM50381856'   

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))	BDBM50381856 (CHEMBL2022464) Show SMILES Cc1cc2c(nc(N3CCC[C@@H](N)C3)n(Cc3ccccc3C#N)c2=O)[nH]1 |r| Show InChI InChI=1S/C20H22N6O/c1-13-9-17-18(23-13)24-20(25-8-4-7-16(22)12-25)26(19(17)27)11-15-6-3-2-5-14(15)10-21/h2-3,5-6,9,16,23H,4,7-8,11-12,22H2,1H3/t16-/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	13.8	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of human DPP4 after 10 mins				Eur J Med Chem 52: 205-12 (2012) Article DOI: 10.1016/j.ejmech.2012.03.015 BindingDB Entry DOI: 10.7270/Q2B8594W
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