BDBM50148637 5-(aminomethyl)-6-(2,4-dichlorophenyl)-N2-(2-methoxyethyl)-N2-methylpyrimidine-2,4-diamine::5-Aminomethyl-6-(2,4-dichloro-phenyl)-N*2*-(2-methoxy-ethyl)-N*2*-methyl-pyrimidine-2,4-diamine::CHEMBL324777
SMILES: COCCN(C)c1nc(N)c(CN)c(n1)-c1ccc(Cl)cc1Cl
InChI Key: InChIKey=GMBQUUCZMIXCEQ-UHFFFAOYSA-N
Data: 2 IC50
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)) | BDBM50148637 (5-(aminomethyl)-6-(2,4-dichlorophenyl)-N2-(2-metho...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
National Health Research Institutes Curated by ChEMBL | Assay Description Inhibition of human DPP4 expressed in baculovirus system | Eur J Med Chem 43: 1603-11 (2008) Article DOI: 10.1016/j.ejmech.2007.11.014 BindingDB Entry DOI: 10.7270/Q2V69JCD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cytochrome P450 3A4 (Homo sapiens (Human)) | BDBM50148637 (5-(aminomethyl)-6-(2,4-dichlorophenyl)-N2-(2-metho...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd Curated by ChEMBL | Assay Description Inhibition of human liver microsome cytochrome P450 3A4 | Bioorg Med Chem Lett 14: 3575-8 (2004) Article DOI: 10.1016/j.bmcl.2004.04.048 BindingDB Entry DOI: 10.7270/Q27H1J2V | |||||||||||
More data for this Ligand-Target Pair |