Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dipeptidyl peptidase 4' and Ligand = 'BDBM12422'   

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))	BDBM12422 ((2-cyclopentylidene-2-fluoroethyl)[(4-fluorophenyl...) Show SMILES F\[#6](-[#6]-[#7]-[#6]-c1ccc(F)cc1)=[#6]-1/[#6]-[#6]-[#6]-[#6]-1 Show InChI InChI=1S/C14H17F2N/c15-13-7-5-11(6-8-13)9-17-10-14(16)12-3-1-2-4-12/h5-8,17H,1-4,9-10H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	8.3	37
University of Antwerp					Assay Description The DPP inhibition was measured by monitoring the cleavage of chromogenic substrate in the presence of each inhibitor compound. IC50 value was determ...				J Med Chem 48: 1768-80 (2005) Article DOI: 10.1021/jm0495982 BindingDB Entry DOI: 10.7270/Q2N014RD
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