BDBM50335758 2-((2-(3-(R)-Aminopiperidin-1-yl)-6-oxo-5-(pyrrolidin-1-yl)pyrimidin-1(6H)-yl)methyl)benzonitrile::CHEMBL1650421

SMILES: N[C@@H]1CCCN(C1)c1ncc(N2CCCC2)c(=O)n1Cc1ccccc1C#N

InChI Key: InChIKey=GDMICCUHBLFSFE-GOSISDBHSA-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 = 50335758   

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))	BDBM50335758 (2-((2-(3-(R)-Aminopiperidin-1-yl)-6-oxo-5-(pyrroli...) Show SMILES N[C@@H]1CCCN(C1)c1ncc(N2CCCC2)c(=O)n1Cc1ccccc1C#N |r| Show InChI InChI=1S/C21H26N6O/c22-12-16-6-1-2-7-17(16)14-27-20(28)19(25-9-3-4-10-25)13-24-21(27)26-11-5-8-18(23)15-26/h1-2,6-7,13,18H,3-5,8-11,14-15,23H2/t18-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Takeda San Diego, Inc. Curated by ChEMBL					Assay Description Inhibition of human DPP4				J Med Chem 54: 510-24 (2011) Article DOI: 10.1021/jm101016w BindingDB Entry DOI: 10.7270/Q24X5828
					More data for this Ligand-Target Pair