Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM50320289'   

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))	BDBM50320289 ((3aR,5beta,6aS)-5-(2-((S)-2-cyanopyrrolidin-1-yl)-...) Show SMILES O=C(CN[C@H]1C[C@H]2CN(C[C@H]2C1)C(=O)N1CCOCC1)N1CCC[C@H]1C#N |r| Show InChI InChI=1S/C19H29N5O3/c20-10-17-2-1-3-24(17)18(25)11-21-16-8-14-12-23(13-15(14)9-16)19(26)22-4-6-27-7-5-22/h14-17,21H,1-9,11-13H2/t14-,15+,16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Hengrui Pharmaceuticals Co., Ltd Curated by ChEMBL					Assay Description Inhibition of DPP4				Bioorg Med Chem Lett 20: 3565-8 (2010) Article DOI: 10.1016/j.bmcl.2010.04.120 BindingDB Entry DOI: 10.7270/Q2P55NQQ
					More data for this Ligand-Target Pair