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BDBM50283604 6-Hydroxymethyl-2-phenylamino-4,5,6,6a-tetrahydro-3aH-cyclopentaoxazole-4,5,6-triol::CHEMBL88408

SMILES: OCC1(O)C(O)C(O)C2N=C(Nc3ccccc3)OC12

InChI Key: InChIKey=WWMAKEJMUWTUCR-UHFFFAOYSA-N

Data: 5 IC50

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 5 hits for monomerid = 50283604   
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
Lysosomal acid glucosylceramidase


(Homo sapiens (Human))
BDBM50283604
PNG
(6-Hydroxymethyl-2-phenylamino-4,5,6,6a-tetrahydro-...)
Show SMILES OCC1(O)C(O)C(O)C2N=C(Nc3ccccc3)OC12 |t:9|
Show InChI InChI=1S/C13H16N2O5/c16-6-13(19)10(18)9(17)8-11(13)20-12(15-8)14-7-4-2-1-3-5-7/h1-5,8-11,16-19H,6H2,(H,14,15)
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Article
n/an/a>3.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against Escherichia coli beta galactosidase


Bioorg Med Chem Lett 4: 2643-2648 (1994)


Article DOI: 10.1016/S0960-894X(01)80688-0
BindingDB Entry DOI: 10.7270/Q21V5FFN
More data for this
Ligand-Target Pair
Alpha-glucosidase


(Bos taurus)
BDBM50283604
PNG
(6-Hydroxymethyl-2-phenylamino-4,5,6,6a-tetrahydro-...)
Show SMILES OCC1(O)C(O)C(O)C2N=C(Nc3ccccc3)OC12 |t:9|
Show InChI InChI=1S/C13H16N2O5/c16-6-13(19)10(18)9(17)8-11(13)20-12(15-8)14-7-4-2-1-3-5-7/h1-5,8-11,16-19H,6H2,(H,14,15)
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Article
n/an/a 1.53E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against bovine liver beta galactosidase


Bioorg Med Chem Lett 4: 2643-2648 (1994)


Article DOI: 10.1016/S0960-894X(01)80688-0
BindingDB Entry DOI: 10.7270/Q21V5FFN
More data for this
Ligand-Target Pair
Alpha glucosidase


(Homo sapiens (Human))
BDBM50283604
PNG
(6-Hydroxymethyl-2-phenylamino-4,5,6,6a-tetrahydro-...)
Show SMILES OCC1(O)C(O)C(O)C2N=C(Nc3ccccc3)OC12 |t:9|
Show InChI InChI=1S/C13H16N2O5/c16-6-13(19)10(18)9(17)8-11(13)20-12(15-8)14-7-4-2-1-3-5-7/h1-5,8-11,16-19H,6H2,(H,14,15)
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Article
n/an/a>3.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against Escherichia coli Alpha-galactosidase


Bioorg Med Chem Lett 4: 2643-2648 (1994)


Article DOI: 10.1016/S0960-894X(01)80688-0
BindingDB Entry DOI: 10.7270/Q21V5FFN
More data for this
Ligand-Target Pair
Lysosomal acid glucosylceramidase


(Homo sapiens (Human))
BDBM50283604
PNG
(6-Hydroxymethyl-2-phenylamino-4,5,6,6a-tetrahydro-...)
Show SMILES OCC1(O)C(O)C(O)C2N=C(Nc3ccccc3)OC12 |t:9|
Show InChI InChI=1S/C13H16N2O5/c16-6-13(19)10(18)9(17)8-11(13)20-12(15-8)14-7-4-2-1-3-5-7/h1-5,8-11,16-19H,6H2,(H,14,15)
PDB
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Reactome pathway
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Article
n/an/a>3.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against baker's yeast Alpha-Glucosidase


Bioorg Med Chem Lett 4: 2643-2648 (1994)


Article DOI: 10.1016/S0960-894X(01)80688-0
BindingDB Entry DOI: 10.7270/Q21V5FFN
More data for this
Ligand-Target Pair
Lysosomal alpha-glucosidase


(Homo sapiens (Human))
BDBM50283604
PNG
(6-Hydroxymethyl-2-phenylamino-4,5,6,6a-tetrahydro-...)
Show SMILES OCC1(O)C(O)C(O)C2N=C(Nc3ccccc3)OC12 |t:9|
Show InChI InChI=1S/C13H16N2O5/c16-6-13(19)10(18)9(17)8-11(13)20-12(15-8)14-7-4-2-1-3-5-7/h1-5,8-11,16-19H,6H2,(H,14,15)
PDB

NCI pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
n/an/a 2.93E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against baker's yeast Alpha-Glucosidase


Bioorg Med Chem Lett 4: 2643-2648 (1994)


Article DOI: 10.1016/S0960-894X(01)80688-0
BindingDB Entry DOI: 10.7270/Q21V5FFN
More data for this
Ligand-Target Pair