BDBM50320112 (2S,4S)-1-(2-(4-(3,4-dihydropyridin-1(2H)-yl)-2-methyl-4-oxobutan-2-ylamino)acetyl)-4-fluoropyrrolidine-2-carbonitrile::CHEMBL1085075

SMILES: CC(C)(CC(=O)N1CCC=CC1)NCC(=O)N1C[C@@H](F)C[C@H]1C#N

InChI Key: InChIKey=OYUIBXZMQCSAHT-KBPBESRZSA-N

Data: 2 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 2 hits for monomerid = 50320112   

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))	BDBM50320112 ((2S,4S)-1-(2-(4-(3,4-dihydropyridin-1(2H)-yl)-2-me...) Show SMILES CC(C)(CC(=O)N1CCC=CC1)NCC(=O)N1C[C@@H](F)C[C@H]1C#N |r,c:9| Show InChI InChI=1S/C17H25FN4O2/c1-17(2,9-15(23)21-6-4-3-5-7-21)20-11-16(24)22-12-13(18)8-14(22)10-19/h3-4,13-14,20H,5-9,11-12H2,1-2H3/t13-,14-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
National Health Research Institutes Curated by ChEMBL					Assay Description Inhibition of DPP4				Bioorg Med Chem Lett 20: 3596-600 (2010) Article DOI: 10.1016/j.bmcl.2010.04.124 BindingDB Entry DOI: 10.7270/Q29Z953W
					More data for this Ligand-Target Pair
Dipeptidyl peptidase VIII (Homo sapiens (Human))	BDBM50320112 ((2S,4S)-1-(2-(4-(3,4-dihydropyridin-1(2H)-yl)-2-me...) Show SMILES CC(C)(CC(=O)N1CCC=CC1)NCC(=O)N1C[C@@H](F)C[C@H]1C#N |r,c:9| Show InChI InChI=1S/C17H25FN4O2/c1-17(2,9-15(23)21-6-4-3-5-7-21)20-11-16(24)22-12-13(18)8-14(22)10-19/h3-4,13-14,20H,5-9,11-12H2,1-2H3/t13-,14-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Health Research Institutes Curated by ChEMBL					Assay Description Inhibition of DPP8				Bioorg Med Chem Lett 20: 3596-600 (2010) Article DOI: 10.1016/j.bmcl.2010.04.124 BindingDB Entry DOI: 10.7270/Q29Z953W
					More data for this Ligand-Target Pair