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Inhibitor Report for: Anagliptin

Anagliptin is an orally available, potent, selective inhibitor of dipeptidyl peptidase 4 (DPP-4), with hypoglycemic activity. Compared to vildagliptin, anagliptin caused longer lasting inhibition of DPP-4 activity


General
Type Drug, Cyanide, Pyrrolidine, Gliptin, Pyrimidine, Carboxamide, Pyrazole
Chemical_Nomenclature N-[2-[[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]amino]-2-methylpropyl]-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxamide
Canonical SMILES CC1=NN2C=C(C=NC2=C1)C(=O)NCC(C)(C)NCC(=O)N3CCCC3C#N
InChI InChI=1S/C19H25N7O2/c1-13-7-16-21-9-14(11-26(16)24-13)18(28)22-12-19(2,3)23-10-17(27)25-6-4-5-15(25)8-20/h7,9,11,15,23H,4-6,10,12H2,1-3H3,(H,22,28)/t15-/m0/s1
InChIKey LDXYBEHACFJIEL-HNNXBMFYSA-N
Other name(s) Suiny ; UNII-K726J96838 ; CHEMBL1929396 ; CHEMBL1929387 ; Anagliptin HCl
________________________________________________________________________________________________
MW|383.45
Formula|C19H25N7O2
CAS_number|739366-20-2
PubChem|44513473
UniChem|LDXYBEHACFJIEL-HNNXBMFYSA-N
IUPHAR|
Wikipedia|

Target
Families | Anagliptin ligand of proteins in family: DPP4N_Peptidase_S9
Stucture | 1 structure: 3WQH: Crystal Structure of human DPP-IV in complex with Anagliptin
Protein | human-DPP4

References:
Search PubMed for references concerning: Anagliptin
    Title: Anagliptin, a potent dipeptidyl peptidase IV inhibitor: its single-crystal structure and enzyme interactions
    Watanabe YS, Yasuda Y, Kojima Y, Okada S, Motoyama T, Takahashi R, Oka M
    Ref: J Enzyme Inhib Med Chem, 30:981, 2015 : PubMed

            

    Title: Discovery and pharmacological characterization of N-[2-({2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl}amino)-2-methylpropyl]-2-methyl pyrazolo[1,5-a]pyrimidine-6-carboxamide hydrochloride (anagliptin hydrochloride salt) as a potent and selective DPP-IV inhibitor
    Kato N, Oka M, Murase T, Yoshida M, Sakairi M, Yamashita S, Yasuda Y, Yoshikawa A, Hayashi Y and Kakigami T <3 more author(s)>
    Ref: Bioorganic & Medicinal Chemistry, 19:7221, 2011 : PubMed