BDBM50338616 (R)-3-amino-4-(2,4,5-trifluorophenyl)-1-(6,7-dihydro-3-(thiophen-3-yl)-[1,2,3]triazolo[1,5-a]pyrazin-5(4H)-yl)butan-1-one fumaric acid::CHEMBL1683999

SMILES: N[C@@H](CC(=O)N1CCn2nnc(-c3ccsc3)c2C1)Cc1cc(F)c(F)cc1F

InChI Key: InChIKey=WYUQFPZWAQMXTO-CYBMUJFWSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50338616   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50338616 ((R)-3-amino-4-(2,4,5-trifluorophenyl)-1-(6,7-dihyd...) Show SMILES N[C@@H](CC(=O)N1CCn2nnc(-c3ccsc3)c2C1)Cc1cc(F)c(F)cc1F |r| Show InChI InChI=1S/C19H18F3N5OS/c20-14-8-16(22)15(21)6-12(14)5-13(23)7-18(28)26-2-3-27-17(9-26)19(24-25-27)11-1-4-29-10-11/h1,4,6,8,10,13H,2-3,5,7,9,23H2/t13-/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	47.3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University of Traditional Chinese Medicine Curated by ChEMBL					Assay Description Inhibition of human DPP4 assessed as hydrolytic reaction of Ala-Pro-AMC				Bioorg Med Chem Lett 21: 1731-5 (2011) Article DOI: 10.1016/j.bmcl.2011.01.086 BindingDB Entry DOI: 10.7270/Q2N58MN7
					More data for this Ligand-Target Pair