BDBM50163440 (2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-triol::(2R,3S,4R,5S)-2-Hydroxymethyl-piperidine-3,4,5-triol::1-deoxygalactonojirimycin::CHEMBL110458::D-galacto-1-Deoxynojirimycin::DGJ

SMILES: C1[C@@H]([C@H]([C@H]([C@H](N1)CO)O)O)O

InChI Key: InChIKey=LXBIFEVIBLOUGU-UHFFFAOYSA-N

Data: 6 KI  17 IC50

PDB links: 11 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 23 hits for monomerid = 50163440   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Beta-glucosidase A (Caldocellum saccharolyticum)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.67E+5	n/a	n/a	n/a	n/a	5.0	n/a
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Alpha-galactosidase A (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
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Alpha-galactosidase A (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-galactosidase (Rat)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-galactosidase (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Alpha-galactosidase C (Aspergillus niger)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Alpha-galactosidase A (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
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Lactase/phlorizin hydrolase (Rat)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Alpha-galactosidase A (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
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Alpha-galactosidase (Arabian coffee)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3	n/a	n/a	n/a	n/a	6.5	n/a
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Maltase-glucoamylase (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Glycogen debranching enzyme (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Lysosomal alpha-glucosidase (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Non-lysosomal glucosylceramidase (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Lactase/phlorizin hydrolase (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Ceramide glucosyltransferase (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Sucrase-isomaltase, intestinal (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Alpha-galactosidase (Arabian coffee)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-galactosidase (Ensifer meliloti)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Beta-galactosidase [24-677,I51T] (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		4.47E+4	-6.17	n/a	n/a	n/a	n/a	n/a	4.5	37
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Beta-galactosidase [24-677,R201C] (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		4.90E+4	-6.11	n/a	n/a	n/a	n/a	n/a	4.5	37
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-galactosidase [24-677] (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		6.18E+4	-5.97	n/a	n/a	n/a	n/a	n/a	4.5	37
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Tissue alpha-L-fucosidase (Human)	BDBM50163440 ((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...) Show SMILES Show InChI	GoogleScholar	UniChem		3.40E+7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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