BindingDB logo
myBDB logout

PDB code 3BUG

Compile Data Set for Download or QSAR

Identical Ligands in BindingDB

Found 1 hit Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Beta-secretase 1

  (408/409 > 99%)
(Homo sapiens (Human))
BDBM50372983
PNG
(CHEMBL255750)
Show SMILES CCc1cc(CCN)ccc1O
Show InChI InChI=1S/C10H15NO/c1-2-9-7-8(5-6-11)3-4-10(9)12/h3-4,7,12H,2,5-6,11H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/an/a 6.60E+5n/an/an/an/an/a



F. Hoffmann-La Roche

Curated by ChEMBL


Assay Description
Binding affinity to BACE1 by surface plasmon resonance method


Bioorg Med Chem Lett 18: 1304-7 (2008)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)

Search BindingMOAD for More Affinity Data:

* indicates data uncertainty>20%
* 0.9 Tanimoto similarity
Identities from BLAST output