null
SMILES: O[C@H](CN(CCc1ccccc1)S(=O)(=O)c1ccccc1)CN1CCN(CC1)C(c1ccccc1)c1ccccc1
InChI Key: InChIKey=AUSSSTYOCBNQQJ-YTTGMZPUSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Beta-secretase 1 (Homo sapiens (Human)) | BDBM50330571 (CHEMBL1278188 | N-[(S)-3-(4-Benzhydryl-piperazin-1...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Pisa Curated by ChEMBL | Assay Description Inhibition of BACE1 by fluorescence assay | Bioorg Med Chem 18: 7991-6 (2010) Article DOI: 10.1016/j.bmc.2010.09.032 BindingDB Entry DOI: 10.7270/Q27944X5 | |||||||||||
More data for this Ligand-Target Pair |