BDBM136855 US10231967, Example 92-Isomer-2::US8865911, 289::US8865911, 92 Isomer 1::US9918985, Example 92 Isomer 2
SMILES: CO[C@H]1CC[C@@]2(Cc3ccc(cc3[C@@]22N=C(C)C(N)=N2)-c2cc(OC)cc(c2)C#N)CC1
InChI Key: InChIKey=SKNSXIIPICYXKY-MZBJOSPHSA-N
Data: 3 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Beta-secretase 1 (Homo sapiens (Human)) | BDBM136855 (US10231967, Example 92-Isomer-2 | US8865911, 289 |...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | US Patent | n/a | n/a | 0.840 | n/a | n/a | n/a | n/a | 9.2 | n/a |
Astrazeneca AB US Patent | Assay Description TR-FRET AssayThe beta-secretase enzyme used in the TR-FRET is prepared as follows: The cDNA for the soluble part of the human beta-Secretase (AA 1-AA... | US Patent US8865911 (2014) BindingDB Entry DOI: 10.7270/Q2T72G4T | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Beta-secretase 1 (aa 1-460) (Homo sapiens (Human)) | BDBM136855 (US10231967, Example 92-Isomer-2 | US8865911, 289 |...) | PDB GoogleScholar AffyNet | PC cid PC sid UniChem Similars | US Patent | n/a | n/a | 5.87E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Tennessee Health Science Center | Assay Description The enzyme (truncated form) was diluted to 6 μg/mL (stock 1.3 mg/mL) and the substrate (Europium)CEVNLDAEFK(Qsy7) to 200 nM (stock 120 μM) ... | J Med Chem 50: 3906-20 (2007) BindingDB Entry DOI: 10.7270/Q2CR5WP7 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Beta-Secretase (AA 1-460) (Homo sapiens (Human)) | BDBM136855 (US10231967, Example 92-Isomer-2 | US8865911, 289 |...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | US Patent | n/a | n/a | 5.87E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universita degli Studi di Bari | Assay Description The β-secretase enzyme used in the TR-FRET is prepared as follows: The cDNA for the soluble part of the human β-Secretase (AA 1-AA 460) was... | J Med Chem 50: 4214-21 (2007) BindingDB Entry DOI: 10.7270/Q2RF5X91 | |||||||||||
More data for this Ligand-Target Pair |