Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM136290'   

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))	BDBM136290 (US8853212, DDP-4 Inhibitor 6) Show SMILES CC(C)(O)Cn1cc2CN(Cc2n1)[C@H]1CSC([C@@H](N)C1)c1cc(F)cc(F)c1F |r| Show InChI InChI=1S/C20H25F3N4OS/c1-20(2,28)10-27-7-11-6-26(8-17(11)25-27)13-5-16(24)19(29-9-13)14-3-12(21)4-15(22)18(14)23/h3-4,7,13,16,19,28H,5-6,8-10,24H2,1-2H3/t13-,16+,19?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	7.5	n/a
Merck Sharp & Dohme Corp US Patent					Assay Description A continuous fluorometric assay is employed with the substrate Gly-Pro-AMC, which is cleaved by DPP-4 to release the fluorescent AMC leaving group. T...				US Patent US8853212 (2014) BindingDB Entry DOI: 10.7270/Q2C53JK4
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