Molecule Details
InChIKeyLDXYBEHACFJIEL-HNNXBMFYSA-N
Compound NameAnagliptin
Canonical SMILESCc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)cn2n1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL7.6
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
DrugBank Annotations
DrugBank ID DB12417
Drug NameAnagliptin
CAS Number739366-20-2
Groups investigational
ATC Codes nan
DescriptionAnagliptin is under investigation for the treatment of LDL Cholesterol, Coronary Disease, Diabetes Mellitus, Glycosylated Hemoglobin, and Dipeptidyl-Peptidase 4 Inhibitors.

Categories: Agents causing angioedema Blood Glucose Lowering Agents DPP-IV Inhibitors Enzyme Inhibitors Protease Inhibitors
Cross-references: BindingDB: 50359366 ChEBI: 136043 CHEMBL1929396 ChemSpider: 28492667 PDB: SKK PubChem:44513473 PubChem:347828661 Wikipedia: Anagliptin ZINC: ZINC000070647144
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
P27487 DPP4 Homo sapiens Human PF00930 PF00326 8.4 IC50 ChEMBL;BindingDB
Q86TI2 DPP9 Homo sapiens Human PF19520 PF00930 PF00326 7.2 IC50 ChEMBL;BindingDB
Q6V1X1 DPP8 Homo sapiens Human PF19520 PF00930 PF00326 7.2 IC50 ChEMBL;BindingDB
DrugBank Target Actions (1)
Target Gene Target Name Action Type
P27487 DPP4 Dipeptidyl peptidase 4 modulator targets