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BDBM50104412 (S)-5-Methyl-piperidine-3,4-diol::CHEMBL86305

SMILES: CC1CNC[C@H](O)C1O

InChI Key: InChIKey=WPRCMXASRHJGNG-XRVVJQKQSA-N

Data: 2 KI  6 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 8 hits for monomerid = 50104412   
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
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50104412
PNG
((S)-5-Methyl-piperidine-3,4-diol | CHEMBL86305)
Show SMILES CC1CNC[C@H](O)C1O
Show InChI InChI=1S/C6H13NO2/c1-4-2-7-3-5(8)6(4)9/h4-9H,2-3H2,1H3/t4?,5-,6?/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Patents


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Article
8.40E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of alpha-fucosidase from bovine kidney(sigma F 5884) at pH 6.8


Bioorg Med Chem Lett 6: 553-558 (1996)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50104412
PNG
((S)-5-Methyl-piperidine-3,4-diol | CHEMBL86305)
Show SMILES CC1CNC[C@H](O)C1O
Show InChI InChI=1S/C6H13NO2/c1-4-2-7-3-5(8)6(4)9/h4-9H,2-3H2,1H3/t4?,5-,6?/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
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CHEMBL
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PC sid
UniChem

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PubMed
8.40E+3n/an/an/an/an/an/an/an/a



Universidad de Sevilla

Curated by ChEMBL


Assay Description
In vitro inhibition of alpha-L-fucosidase isolated from bovine kidney.


Citation and Details
More data for this
Ligand-Target Pair
Beta-galactosidase


(Homo sapiens)
BDBM50104412
PNG
((S)-5-Methyl-piperidine-3,4-diol | CHEMBL86305)
Show SMILES CC1CNC[C@H](O)C1O
Show InChI InChI=1S/C6H13NO2/c1-4-2-7-3-5(8)6(4)9/h4-9H,2-3H2,1H3/t4?,5-,6?/m0/s1
PDB

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KEGG

UniProtKB/SwissProt

B.MOAD
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UniChem

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Article
n/an/a>1.00E+6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of beta-galactosidase from aspergillus oryzae (sigma G 7256).


Bioorg Med Chem Lett 6: 553-558 (1996)

More data for this
Ligand-Target Pair
Alpha-mannosidase


(Glycine max)
BDBM50104412
PNG
((S)-5-Methyl-piperidine-3,4-diol | CHEMBL86305)
Show SMILES CC1CNC[C@H](O)C1O
Show InChI InChI=1S/C6H13NO2/c1-4-2-7-3-5(8)6(4)9/h4-9H,2-3H2,1H3/t4?,5-,6?/m0/s1
KEGG

GoogleScholar
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PC sid
UniChem

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Article
n/an/a>1.00E+6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of jack bean alpha-mannosidase


Bioorg Med Chem Lett 6: 553-558 (1996)

More data for this
Ligand-Target Pair
Glucocerebrosidase (Acid beta-Glucosidase)


(Homo sapiens (human))
BDBM50104412
PNG
((S)-5-Methyl-piperidine-3,4-diol | CHEMBL86305)
Show SMILES CC1CNC[C@H](O)C1O
Show InChI InChI=1S/C6H13NO2/c1-4-2-7-3-5(8)6(4)9/h4-9H,2-3H2,1H3/t4?,5-,6?/m0/s1
PDB
MMDB

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Article
n/an/a 5.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of beta-glucosidase from almonds(sigma G 4511).


Bioorg Med Chem Lett 6: 553-558 (1996)

More data for this
Ligand-Target Pair
Alpha-glucosidase A (α-Gal A)


(Homo sapiens (Human))
BDBM50104412
PNG
((S)-5-Methyl-piperidine-3,4-diol | CHEMBL86305)
Show SMILES CC1CNC[C@H](O)C1O
Show InChI InChI=1S/C6H13NO2/c1-4-2-7-3-5(8)6(4)9/h4-9H,2-3H2,1H3/t4?,5-,6?/m0/s1
PDB
MMDB

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PC sid
UniChem

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Article
n/an/a>1.00E+6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of alpha-galactosidase from green coffee beans (sigma G 8507).


Bioorg Med Chem Lett 6: 553-558 (1996)

More data for this
Ligand-Target Pair
Lysosomal alpha-glucosidase


(Homo sapiens)
BDBM50104412
PNG
((S)-5-Methyl-piperidine-3,4-diol | CHEMBL86305)
Show SMILES CC1CNC[C@H](O)C1O
Show InChI InChI=1S/C6H13NO2/c1-4-2-7-3-5(8)6(4)9/h4-9H,2-3H2,1H3/t4?,5-,6?/m0/s1
PDB

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UniProtKB/SwissProt

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PC sid
UniChem

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Article
n/an/a>1.00E+6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of alpha-glucosidase from yeast(sigma G 7256).


Bioorg Med Chem Lett 6: 553-558 (1996)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50104412
PNG
((S)-5-Methyl-piperidine-3,4-diol | CHEMBL86305)
Show SMILES CC1CNC[C@H](O)C1O
Show InChI InChI=1S/C6H13NO2/c1-4-2-7-3-5(8)6(4)9/h4-9H,2-3H2,1H3/t4?,5-,6?/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


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Article
n/an/a 2.60E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of alpha-fucosidase from bovine kidney(sigma F 5884).


Bioorg Med Chem Lett 6: 553-558 (1996)

More data for this
Ligand-Target Pair