CHEMBL1688431-Cpd4e7
C50: 10 (DPP-4) and 6600 nM (DPP-8)
General
Type : Pyridine, Cyanide, Organochlorine
Chemical_Nomenclature : 5-(aminomethyl)-N-(cyanomethyl)-4-(2,4-dichlorophenyl)-6-methylpyridine-2-carboxamide
Canonical SMILES : CC1=C(C(=CC(=N1)C(=O)NCC#N)C2=C(C=C(C=C2)Cl)Cl)CN
InChI : InChI=1S\/C16H14Cl2N4O\/c1-9-13(8-20)12(11-3-2-10(17)6-14(11)18)7-15(22-9)16(23)21-5-4-19\/h2-3,6-7H,5,8,20H2,1H3,(H,21,23)
InChIKey : GWFVXNYRMACYQP-UHFFFAOYSA-N
Other name(s) : Compound 4e7 || SCHEMBL12807244 || BDBM50339103 || 5-Aminomethyl-4-(2,4-dichlorophenyl)-6-methyl-pyridine-2-carboxylic acid cyanomethyl-amide
MW : 349.2
Formula : C16H14Cl2N4O
CAS_number :
PubChem : 49837961
UniChem : GWFVXNYRMACYQP-UHFFFAOYSA-N
Target
Families : CHEMBL1688431-Cpd4e7 ligand of proteins in family
DPP4N_Peptidase_S9
Protein :
human-DPP4
References (1)
| Title : Design, Synthesis, and in Vitro Evaluation of Novel Aminomethyl-pyridines as DPP-4 Inhibitors - Kaczanowska_2010_ACS.Med.Chem.Lett_1_530 |
| Author(s) : Kaczanowska K , Wiesmuller KH , Schaffner AP |
| Ref : ACS Med Chem Lett , 1 :530 , 2010 |
| Abstract : |
| PubMedSearch : Kaczanowska_2010_ACS.Med.Chem.Lett_1_530 |
| PubMedID: 24900243 |