BDBM13803 2-{[2-(3-aminopiperidin-1-yl)-5-methyl-4-oxo-1H,4H,5H-imidazo[4,5-d]pyridazin-1-yl]methyl}benzonitrile::Xanthine mimetic compound 18
SMILES: Cn1ncc2n(Cc3ccccc3C#N)c(nc2c1=O)N1CCCC(N)C1
InChI Key: InChIKey=LBOOXTLFQGNNED-UHFFFAOYSA-N
Data: 1 KI
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)) | BDBM13803 (2-{[2-(3-aminopiperidin-1-yl)-5-methyl-4-oxo-1H,4H...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 260 | -8.89 | n/a | n/a | n/a | n/a | n/a | 7.5 | 22 |
Abbott Laboratories | Assay Description The DPP activity resulted in the formation of the fluorescent product amidomethylcoumarin (AMC), which was monitored by excitation at 355 nm and meas... | Bioorg Med Chem Lett 16: 6226-30 (2006) Article DOI: 10.1016/j.bmcl.2006.09.024 BindingDB Entry DOI: 10.7270/Q2MP51H4 | |||||||||||
More data for this Ligand-Target Pair |