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BDBM28921 (2S,3S)-N-(4-bromophenyl)-1-hydroxy-3-methylpentane-2-sulfonamido::BMCL184232 Compound 2e::Begacestat analogue, 2

SMILES: CC[C@H](C)[C@@H](CO)NS(=O)(=O)c1ccc(Br)cc1

InChI Key: InChIKey=KRCRTCGHANKNGN-JOYOIKCWSA-N

Data: 2 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 28921   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Gamma-Secretase


(Homo sapiens (Human))
BDBM28921
PNG
((2S,3S)-N-(4-bromophenyl)-1-hydroxy-3-methylpentan...)
Show SMILES CC[C@H](C)[C@@H](CO)NS(=O)(=O)c1ccc(Br)cc1 |r|
Show InChI InChI=1S/C12H18BrNO3S/c1-3-9(2)12(8-15)14-18(16,17)11-6-4-10(13)5-7-11/h4-7,9,12,14-15H,3,8H2,1-2H3/t9-,12+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.21E+3n/an/an/an/a



Wyeth Research



Assay Description
A Chinese Hamster Ovary cell line stably expressing human beta-APP were aliquoted into a 96-well plate, and after attachment the medium was replaced ...


Bioorg Med Chem Lett 18: 4232-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.064
BindingDB Entry DOI: 10.7270/Q26Q1VJM
More data for this
Ligand-Target Pair
Gamma-Secretase


(Homo sapiens (Human))
BDBM28921
PNG
((2S,3S)-N-(4-bromophenyl)-1-hydroxy-3-methylpentan...)
Show SMILES CC[C@H](C)[C@@H](CO)NS(=O)(=O)c1ccc(Br)cc1 |r|
Show InChI InChI=1S/C12H18BrNO3S/c1-3-9(2)12(8-15)14-18(16,17)11-6-4-10(13)5-7-11/h4-7,9,12,14-15H,3,8H2,1-2H3/t9-,12+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.21E+3n/an/an/an/a



Wyeth Research



Assay Description
A Chinese Hamster Ovary cell line stably expressing human beta-APP were aliquoted into a 96-well plate, and after attachment the medium was replaced ...


J Med Chem 51: 7348-51 (2008)


Article DOI: 10.1021/jm801252w
BindingDB Entry DOI: 10.7270/Q2BC3WW2
More data for this
Ligand-Target Pair