Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM50242532'   

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))	BDBM50242532 ((2S,4S)-4-Fluoro-1-[N-(3-methoxy-1-adamantyl)-glyc...) Show SMILES COC12CC3CC(CC(C3)(C1)NCC(=O)N1C[C@@H](F)C[C@H]1C#N)C2 |r,TLB:9:4:23:10.8.7,9:8:3.4.5:23,11:8:3:5.6.23,THB:7:8:3:5.6.23,7:6:3:10.9.8| Show InChI InChI=1S/C18H26FN3O2/c1-24-18-6-12-2-13(7-18)5-17(4-12,11-18)21-9-16(23)22-10-14(19)3-15(22)8-20/h12-15,21H,2-7,9-11H2,1H3/t12?,13?,14-,15-,17?,18?/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	8.30	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of DPP4 in human plasma by fluorescence assay				Bioorg Med Chem 16: 4093-106 (2008) Article DOI: 10.1016/j.bmc.2008.01.016 BindingDB Entry DOI: 10.7270/Q27H1KGN
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