BDBM126822 US8785477, Sitagliptin
SMILES: NC(CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc1cc(F)c(F)cc1F
InChI Key: InChIKey=MFFMDFFZMYYVKS-UHFFFAOYSA-N
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 IV (Rattus norvegicus (rat)) | BDBM126822![]() (US8785477, Sitagliptin) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar | Purchase PC cid PC sid PDB UniChem Similars | PDB US Patent | n/a | n/a | 26.0 | n/a | n/a | n/a | n/a | n/a | n/a |
Shanghai Sun-Sail Pharmaceutical Science & Technology Co., Ltd. US Patent | Assay Description Thoroughly mixed test compounds, enzyme and reaction buffer, preincubated the mixture for 15 minutes at 37° C. and then primed reaction by adding sub... | US Patent US8785477 (2014) BindingDB Entry DOI: 10.7270/Q20K278Q | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) |