BDBM50114808 CHEMBL3609753
SMILES: Cc1cn(cn1)-c1ccc(cc1OC(F)(F)F)-c1cn(nn1)C1CCc2c(F)cccc2C(CC(F)(F)F)C1=O
InChI Key: InChIKey=QZKUUTWEUPOQOZ-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50114808 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 |
Gamma-Secretase Subunit APH-1A/Gamma-Secretase Subunit PEN-2/Gamma-Secretase Subunit Presenilin-1/Gamma-secretase subunit APH-1B/Nicastrin /Presenilin 2
(Homo sapiens (Human)) | BDBM50114808
(CHEMBL3609753)Show SMILES Cc1cn(cn1)-c1ccc(cc1OC(F)(F)F)-c1cn(nn1)C1CCc2c(F)cccc2C(CC(F)(F)F)C1=O Show InChI InChI=1S/C26H20F7N5O2/c1-14-11-37(13-34-14)21-7-5-15(9-23(21)40-26(31,32)33)20-12-38(36-35-20)22-8-6-17-16(3-2-4-19(17)27)18(24(22)39)10-25(28,29)30/h2-5,7,9,11-13,18,22H,6,8,10H2,1H3 | PDB
KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 210 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Modulation of gamma-secretase in human SH-SY5Y cells overexpressing APP C-terminal fragment SPA4CT assessed as inhibition of intracellular amyloid be... |
Bioorg Med Chem Lett 25: 3495-500 (2015)
BindingDB Entry DOI: 10.7270/Q2125VFP |
More data for this Ligand-Target Pair | |
Gamma-Secretase Subunit APH-1A/Gamma-Secretase Subunit PEN-2/Gamma-Secretase Subunit Presenilin-1/Gamma-secretase subunit APH-1B/Nicastrin /Presenilin 2
(Homo sapiens (Human)) | BDBM50114808
(CHEMBL3609753)Show SMILES Cc1cn(cn1)-c1ccc(cc1OC(F)(F)F)-c1cn(nn1)C1CCc2c(F)cccc2C(CC(F)(F)F)C1=O Show InChI InChI=1S/C26H20F7N5O2/c1-14-11-37(13-34-14)21-7-5-15(9-23(21)40-26(31,32)33)20-12-38(36-35-20)22-8-6-17-16(3-2-4-19(17)27)18(24(22)39)10-25(28,29)30/h2-5,7,9,11-13,18,22H,6,8,10H2,1H3 | PDB
KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 1.31E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Modulation of gamma-secretase in human SH-SY5Y cells overexpressing APP C-terminal fragment SPA4CT assessed as inhibition of intracellular amyloid be... |
Bioorg Med Chem Lett 25: 3495-500 (2015)
BindingDB Entry DOI: 10.7270/Q2125VFP |
More data for this Ligand-Target Pair | |