BDBM50335798 2-[2-(3-(R)-Aminopiperidin-1-yl)-6-oxo-5-((E)-2-pyridin-3-ylvinyl)-6H-pyrimidin-1-ylmethyl]benzonitrile::CHEMBL1650429

SMILES: N[C@@H]1CCCN(C1)c1ncc(\C=C\c2cccnc2)c(=O)n1Cc1ccccc1C#N

InChI Key: InChIKey=OYAVNTBEYOHBMO-DGSRBQDKSA-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 = 50335798   

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 VIII (Homo sapiens (Human))	BDBM50335798 (2-[2-(3-(R)-Aminopiperidin-1-yl)-6-oxo-5-((E)-2-py...) Show SMILES N[C@@H]1CCCN(C1)c1ncc(\C=C\c2cccnc2)c(=O)n1Cc1ccccc1C#N |r| Show InChI InChI=1S/C24H24N6O/c25-13-19-6-1-2-7-21(19)16-30-23(31)20(10-9-18-5-3-11-27-14-18)15-28-24(30)29-12-4-8-22(26)17-29/h1-3,5-7,9-11,14-15,22H,4,8,12,16-17,26H2/b10-9+/t22-/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	8.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Takeda San Diego, Inc. Curated by ChEMBL					Assay Description Inhibition of human DPP8				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
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50335798 (2-[2-(3-(R)-Aminopiperidin-1-yl)-6-oxo-5-((E)-2-py...) Show SMILES N[C@@H]1CCCN(C1)c1ncc(\C=C\c2cccnc2)c(=O)n1Cc1ccccc1C#N |r| Show InChI InChI=1S/C24H24N6O/c25-13-19-6-1-2-7-21(19)16-30-23(31)20(10-9-18-5-3-11-27-14-18)15-28-24(30)29-12-4-8-22(26)17-29/h1-3,5-7,9-11,14-15,22H,4,8,12,16-17,26H2/b10-9+/t22-/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	6	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