BDBM18464 2-({4-[(3-chlorophenyl)amino]-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl}amino)ethan-1-ol::triazine scaffold, 29
SMILES: OCCNc1nc(Nc2cccc(Cl)c2)nc(n1)N1CCCC1
InChI Key: InChIKey=YGWBHVPEPQIPHJ-UHFFFAOYSA-N
Data: 1 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Lysosomal acid glucosylceramidase (Homo sapiens (Human)) | BDBM18464 (2-({4-[(3-chlorophenyl)amino]-6-(pyrrolidin-1-yl)-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.69E+3 | n/a | n/a | n/a | n/a | 5.9 | 21 |
NIH | Assay Description Enzyme activity was determined as the production of fluorescent resorufin from the substrate. The fluorescence was measured (excitation 570 nm, emiss... | Bioorg Med Chem Lett 17: 5783-9 (2007) Article DOI: 10.1016/j.bmcl.2007.08.050 BindingDB Entry DOI: 10.7270/Q2Q81BBW | |||||||||||
More data for this Ligand-Target Pair |