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BDBM50279837 (3S,4R,5R)-Tetrahydro-pyran-3,4,5-triol::CHEMBL161229

SMILES: O[C@H]1COC[C@@H](O)[C@@H]1O

InChI Key: InChIKey=QXAMTEJJAZOINB-SCDXWVJYSA-N

Data: 2 KI

PDB links: 209 PDB IDs match this monomer.

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 = 50279837   
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
Beta-glucosidase


(Prunus avium)
BDBM50279837
PNG
((3S,4R,5R)-Tetrahydro-pyran-3,4,5-triol | CHEMBL16...)
Show SMILES O[C@H]1COC[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C5H10O4/c6-3-1-9-2-4(7)5(3)8/h3-8H,1-2H2/t3-,4+,5+
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CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
3.90E+7n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity towards sweet almond Beta-glucosidase


Bioorg Med Chem Lett 1: 667-672 (1991)

More data for this
Ligand-Target Pair
Beta-galactosidase


(Escherichia coli)
BDBM50279837
PNG
((3S,4R,5R)-Tetrahydro-pyran-3,4,5-triol | CHEMBL16...)
Show SMILES O[C@H]1COC[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C5H10O4/c6-3-1-9-2-4(7)5(3)8/h3-8H,1-2H2/t3-,4+,5+
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
8.50E+7n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated for its binding affinity towards E-coli Beta-galactosidase


Bioorg Med Chem Lett 1: 667-672 (1991)

More data for this
Ligand-Target Pair