Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM50338413'   

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))	BDBM50338413 (CHEMBL1683119 | trans-1-(4-((R)-1-amino-2-(2,5-dif...) Show SMILES N[C@H](Cc1cc(F)ccc1F)[C@H]1CC[C@@H](CC1)N1CCCC(C1)C(N)=O |r,wU:1.0,14.18,wD:11.17,(39.76,4.71,;39.77,3.17,;38.43,2.4,;37.1,3.17,;37.09,4.72,;35.76,5.48,;35.75,7.02,;34.43,4.71,;34.43,3.17,;35.76,2.4,;35.76,.86,;41.1,2.41,;41.1,.87,;42.42,.1,;43.76,.87,;43.76,2.41,;42.43,3.19,;45.09,.09,;46.42,.87,;47.75,.09,;47.75,-1.45,;46.4,-2.21,;45.08,-1.44,;46.4,-3.75,;47.73,-4.53,;45.06,-4.52,)| Show InChI InChI=1S/C20H29F2N3O/c21-16-5-8-18(22)15(10-16)11-19(23)13-3-6-17(7-4-13)25-9-1-2-14(12-25)20(24)26/h5,8,10,13-14,17,19H,1-4,6-7,9,11-12,23H2,(H2,24,26)/t13-,14?,17-,19-/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	57	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of DPP4				Bioorg Med Chem Lett 21: 1880-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.060 BindingDB Entry DOI: 10.7270/Q2SX6DJG
					More data for this Ligand-Target Pair