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Compile Data Set for Download or QSAR

Marvin 2D Structure

Wt: 147.1
BDBM50065258
Purchase
Wt: 147.1
BDBM50179480
Wt: 163.1
BDBM50179483
Wt: 147.1
BDBM50242267
Purchase
Wt: 147.1
BDBM50242268
Purchase
Wt: 147.1
BDBM50242269
Wt: 147.1
BDBM50304626
Wt: 163.1
BDBM50304627
Wt: 115.1
BDBM50304628
Wt: 159.1
BDBM50304629
Wt: 162.1
BDBM50321921
Wt: 161.1
BDBM50360268
Wt: 161.1
BDBM50360269
Wt: 147.1
BDBM50350760
Purchase
Wt: 163.1
BDBM50437446
Displayed 1 to 15 (of 58 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 50 hits in this display   
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
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50304627
PNG
((2S,3S,4R,5R,6S)-6-methylpiperidine-2,3,4,5-tetrao...)
Show SMILES C[C@@H]1N[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c1-2-3(8)4(9)5(10)6(11)7-2/h2-11H,1H3/t2-,3+,4+,5-,6-/m0/s1
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1n/an/an/an/an/an/an/an/a



Universit£ de Reims Champagne-Ardenne

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase by para-nitrophenolate release assay


Bioorg Med Chem 17: 8020-6 (2009)


Article DOI: 10.1016/j.bmc.2009.10.010
BindingDB Entry DOI: 10.7270/Q2FB5307
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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1.70n/an/an/an/an/an/an/an/a



Toyama Medical and Pharmaceutical University

Curated by ChEMBL


Assay Description
Ki value against bovine alpha-L-fucosidase


J Med Chem 48: 2036-44 (2005)


Article DOI: 10.1021/jm0495881
BindingDB Entry DOI: 10.7270/Q2DF6S0M
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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3n/an/an/an/an/an/an/an/a



Universit£ de Reims Champagne-Ardenne

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase by para-nitrophenolate release assay


Bioorg Med Chem 17: 8020-6 (2009)


Article DOI: 10.1016/j.bmc.2009.10.010
BindingDB Entry DOI: 10.7270/Q2FB5307
More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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6.20n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for inhibitory activity (competitive) against alpha-L-fucosidase from bovine kidney


Bioorg Med Chem Lett 5: 2169-2174 (1995)


Article DOI: 10.1016/0960-894X(95)00377-6
BindingDB Entry DOI: 10.7270/Q2Z038N8
More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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6.20n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibitory activity against alpha-L-fucosidase from bovine epididymus (sigma)


Bioorg Med Chem Lett 3: 2533-2536 (1993)


Article DOI: 10.1016/S0960-894X(01)80711-3
BindingDB Entry DOI: 10.7270/Q2BG2PGV
More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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6.20n/an/an/an/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound was determined against alpha-L-fucosidase in bovine epididymis; Competitive Inhibition type


Bioorg Med Chem Lett 8: 3265-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00596-4
BindingDB Entry DOI: 10.7270/Q24J0D9C
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 2


(Homo sapiens)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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9.80n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibitory activity against alpha-L-fucosidase from solubilised human neutrophils


Bioorg Med Chem Lett 3: 2533-2536 (1993)


Article DOI: 10.1016/S0960-894X(01)80711-3
BindingDB Entry DOI: 10.7270/Q2BG2PGV
More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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10n/an/an/an/an/an/an/an/a



Technische Universität Graz

Curated by ChEMBL


Assay Description
Inhibition of human liver alpha-L-fucosidase


Bioorg Med Chem Lett 16: 2067-70 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.095
BindingDB Entry DOI: 10.7270/Q26Q1WV2
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50304628
PNG
((2S,3R,4S)-2-methyl-3,4-dihydro-2H-pyrrole-3,4-dio...)
Show SMILES C[C@@H]1NC[C@H](O)C1=O
Show InChI InChI=1S/C5H9NO2/c1-3-5(8)4(7)2-6-3/h3-4,6-7H,2H2,1H3/t3-,4-/m0/s1
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10n/an/an/an/an/an/an/an/a



Universit£ de Reims Champagne-Ardenne

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase by para-nitrophenolate release assay


Bioorg Med Chem 17: 8020-6 (2009)


Article DOI: 10.1016/j.bmc.2009.10.010
BindingDB Entry DOI: 10.7270/Q2FB5307
More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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29n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition constant against Alpha-Fucosidase


Bioorg Med Chem Lett 2: 33-36 (1992)


Article DOI: 10.1016/S0960-894X(00)80649-6
BindingDB Entry DOI: 10.7270/Q2FF3SV0
More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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31n/an/an/an/an/an/an/an/a



Keio University

Curated by ChEMBL


Assay Description
Binding affinity against alpha-L-fucosidase in bovine kidney was determined


Bioorg Med Chem Lett 12: 2811-4 (2002)


Article DOI: 10.1016/s0960-894x(02)00627-3
BindingDB Entry DOI: 10.7270/Q2C24WZJ
More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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80n/an/an/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibitory activity measured against alpha-L-fucosidase of bovine epididymis by colorimetric assay using the D-glucose oxidase-peroxidase method


J Med Chem 41: 2565-71 (1998)


Article DOI: 10.1021/jm970836l
BindingDB Entry DOI: 10.7270/Q25D8SHK
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50242268
PNG
(2,5-Imino-1,2,5-trideoxy-L-glucitol | CHEMBL502230)
Show SMILES C[C@H]1N[C@@H](CO)[C@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(2-8)7-3/h3-10H,2H2,1H3/t3-,4+,5+,6+/m1/s1
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490n/an/an/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of bovine epididymis alpha-L-fucosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50304626
PNG
((2R,3S,4S,5S)-2-methylpiperidine-3,4,5-triol | CHE...)
Show SMILES C[C@H]1NC[C@H](O)[C@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6+/m1/s1
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1.00E+3n/an/an/an/an/an/an/an/a



Universit£ de Reims Champagne-Ardenne

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase by para-nitrophenolate release assay


Bioorg Med Chem 17: 8020-6 (2009)


Article DOI: 10.1016/j.bmc.2009.10.010
BindingDB Entry DOI: 10.7270/Q2FB5307
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50179483
PNG
(CHEMBL203863 | D-fuco-nojirimycin)
Show SMILES C[C@H]1NC(O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO4/c1-2-3(8)4(9)5(10)6(11)7-2/h2-11H,1H3/t2-,3+,4+,5-,6?/m1/s1
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3.00E+3n/an/an/an/an/an/an/an/a



Université de Haute-Alsace

Curated by ChEMBL


Assay Description
Inhibition of bovine alpha-L-fucosidase


Bioorg Med Chem Lett 16: 1172-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.100
BindingDB Entry DOI: 10.7270/Q2Q81CNB
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50321921
PNG
((3S,4S,5R,6S)-3-Hydroxymethyl-6-methylhexahydropyr...)
Show SMILES C[C@@H]1NN[C@@H](CO)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H14N2O3/c1-3-5(10)6(11)4(2-9)8-7-3/h3-11H,2H2,1H3/t3-,4-,5+,6-/m0/s1
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4.20E+3n/an/an/an/an/an/an/an/a



University of Seville

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha L-fucosidase


Bioorg Med Chem 18: 4648-60 (2011)


Article DOI: 10.1016/j.bmc.2010.05.026
BindingDB Entry DOI: 10.7270/Q2G161TR
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50437446
PNG
(CHEMBL2409341)
Show SMILES O[C@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-3-1-7-2-4(9)6(11)5(3)10/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1
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4.60E+3n/an/an/an/an/an/an/an/a



Universit£ de Poitiers

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase


Bioorg Med Chem 21: 4803-12 (2013)


Article DOI: 10.1016/j.bmc.2013.03.035
BindingDB Entry DOI: 10.7270/Q2GQ7053
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50304629
PNG
((6R,7S,8R)-4-azaspiro[2.5]octane-6,7,8-triol | CHE...)
Show SMILES O[C@@H]1CNC2(CC2)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C7H13NO3/c9-4-3-8-7(1-2-7)6(11)5(4)10/h4-6,8-11H,1-3H2/t4-,5+,6+/m1/s1
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1.80E+4n/an/an/an/an/an/an/an/a



Universit£ de Reims Champagne-Ardenne

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase by para-nitrophenolate release assay


Bioorg Med Chem 17: 8020-6 (2009)


Article DOI: 10.1016/j.bmc.2009.10.010
BindingDB Entry DOI: 10.7270/Q2FB5307
More data for this
Ligand-Target Pair
α-galactosidase


(Coffea arabica (Coffee beans))
BDBM50437446
PNG
(CHEMBL2409341)
Show SMILES O[C@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-3-1-7-2-4(9)6(11)5(3)10/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1
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5.40E+4n/an/an/an/an/an/an/an/a



Universit£ de Poitiers

Curated by ChEMBL


Assay Description
Inhibition of coffee bean alpha-galactosidase


Bioorg Med Chem 21: 4803-12 (2013)


Article DOI: 10.1016/j.bmc.2013.03.035
BindingDB Entry DOI: 10.7270/Q2GQ7053
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50179480
PNG
((2R,3S,4R,5S)-2-methylpiperidine-3,4,5-triol | CHE...)
Show SMILES C[C@H]1NC[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m1/s1
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6.60E+5n/an/an/an/an/an/an/an/a



Université de Haute-Alsace

Curated by ChEMBL


Assay Description
Inhibition of bovine alpha-L-fucosidase


Bioorg Med Chem Lett 16: 1172-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.100
BindingDB Entry DOI: 10.7270/Q2Q81CNB
More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50179480
PNG
((2R,3S,4R,5S)-2-methylpiperidine-3,4,5-triol | CHE...)
Show SMILES C[C@H]1NC[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m1/s1
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7.90E+6n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition constant against Alpha-Fucosidase


Bioorg Med Chem Lett 2: 33-36 (1992)


Article DOI: 10.1016/S0960-894X(00)80649-6
BindingDB Entry DOI: 10.7270/Q2FF3SV0
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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n/an/a 5n/an/an/an/an/an/a



Université de Haute-Alsace

Curated by ChEMBL


Assay Description
Inhibition of bovine alpha-L-fucosidase


Bioorg Med Chem Lett 16: 1172-4 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.100
BindingDB Entry DOI: 10.7270/Q2Q81CNB
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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n/an/a 110n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase assessed as inhibition of release of p-nitrophenol by spectrophotometry


Bioorg Med Chem 21: 6565-73 (2013)


Article DOI: 10.1016/j.bmc.2013.08.028
BindingDB Entry DOI: 10.7270/Q2G73G5J
More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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n/an/a 140n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of human lysosome alpha-L-fucosidase using 4-methylumbelliferyl-alpha-L-fucopyranoside by spectrophotometry


Bioorg Med Chem 21: 6565-73 (2013)


Article DOI: 10.1016/j.bmc.2013.08.028
BindingDB Entry DOI: 10.7270/Q2G73G5J
More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Rattus norvegicus)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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n/an/a 340n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis alpha-L-fucosidase assessed as inhibition of release of p-nitrophenol by spectrophotometry


Bioorg Med Chem 21: 6565-73 (2013)


Article DOI: 10.1016/j.bmc.2013.08.028
BindingDB Entry DOI: 10.7270/Q2G73G5J
More data for this
Ligand-Target Pair
Alpha-L-fucosidase I


(Homo sapiens)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
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n/an/a 410n/an/an/an/an/an/a



Keio University

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase


Bioorg Med Chem Lett 12: 2811-4 (2002)


Article DOI: 10.1016/s0960-894x(02)00627-3
BindingDB Entry DOI: 10.7270/Q2C24WZJ
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50242268
PNG
(2,5-Imino-1,2,5-trideoxy-L-glucitol | CHEMBL502230)
Show SMILES C[C@H]1N[C@@H](CO)[C@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(2-8)7-3/h3-10H,2H2,1H3/t3-,4+,5+,6+/m1/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of bovine epididymis alpha-L-fucosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Ceramide glucosyltransferase


(Mus musculus)
BDBM50350760
PNG
(CHEMBL1818436)
Show SMILES OC[C@@H]1NCC[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c8-3-4-6(10)5(9)1-2-7-4/h4-10H,1-3H2/t4-,5+,6-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of glucosylceramide synthase in mouse RAW cells preincubated for 15 mins followed by substrate addition and measured after 1 hr by fluores...


ACS Med Chem Lett 2: 519-522 (2011)


Article DOI: 10.1021/ml200050s
BindingDB Entry DOI: 10.7270/Q28916V8
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50360268
PNG
(CHEMBL1933098)
Show SMILES C[C@@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H15NO3/c1-4-2-8-3-5(9)7(11)6(4)10/h4-11H,2-3H2,1H3/t4-,5-,6-,7-/m1/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



UMR CNRS 7201

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Bioorg Med Chem 20: 641-9 (2012)


Article DOI: 10.1016/j.bmc.2010.09.053
BindingDB Entry DOI: 10.7270/Q2GB24HJ
More data for this
Ligand-Target Pair
β-galactosidase


(Bos taurus (Bovine))
BDBM50242267
PNG
(2,5-imino-1,2,5-trideoxy-D-mannitol | CHEMBL443158)
Show SMILES C[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(2-8)7-3/h3-10H,2H2,1H3/t3-,4-,5-,6-/m1/s1
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n/an/a 3.00E+4n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of bovine liver beta-galactosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50321921
PNG
((3S,4S,5R,6S)-3-Hydroxymethyl-6-methylhexahydropyr...)
Show SMILES C[C@@H]1NN[C@@H](CO)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H14N2O3/c1-3-5(10)6(11)4(2-9)8-7-3/h3-11H,2H2,1H3/t3-,4-,5+,6-/m0/s1
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n/an/a 3.00E+4n/an/an/an/an/an/a



University of Seville

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha L-fucosidase


Bioorg Med Chem 18: 4648-60 (2011)


Article DOI: 10.1016/j.bmc.2010.05.026
BindingDB Entry DOI: 10.7270/Q2G161TR
More data for this
Ligand-Target Pair
Beta-glucosidase


(Homo sapiens)
BDBM50350760
PNG
(CHEMBL1818436)
Show SMILES OC[C@@H]1NCC[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c8-3-4-6(10)5(9)1-2-7-4/h4-10H,1-3H2/t4-,5+,6-/m0/s1
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n/an/a 3.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of glucosylceramidase 2 from spleen of patient with gaucher's disease by fluorimetric analysis


ACS Med Chem Lett 2: 519-522 (2011)


Article DOI: 10.1021/ml200050s
BindingDB Entry DOI: 10.7270/Q28916V8
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50242269
PNG
(2,5-dideoxy-2,5-imino-D-fucitol | CHEMBL458368)
Show SMILES C[C@H]1N[C@@H](CO)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(2-8)7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m1/s1
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n/an/a 3.50E+4n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of bovine epididymis alpha-L-fucosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50360268
PNG
(CHEMBL1933098)
Show SMILES C[C@@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H15NO3/c1-4-2-8-3-5(9)7(11)6(4)10/h4-11H,2-3H2,1H3/t4-,5-,6-,7-/m1/s1
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n/an/a 6.40E+4n/an/an/an/an/an/a



UMR CNRS 7201

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase


Bioorg Med Chem 20: 641-9 (2012)


Article DOI: 10.1016/j.bmc.2010.09.053
BindingDB Entry DOI: 10.7270/Q2GB24HJ
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50242267
PNG
(2,5-imino-1,2,5-trideoxy-D-mannitol | CHEMBL443158)
Show SMILES C[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(2-8)7-3/h3-10H,2H2,1H3/t3-,4-,5-,6-/m1/s1
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n/an/a 9.30E+4n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Lactase-glycosylceramidase


(Rattus norvegicus)
BDBM50350760
PNG
(CHEMBL1818436)
Show SMILES OC[C@@H]1NCC[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c8-3-4-6(10)5(9)1-2-7-4/h4-10H,1-3H2/t4-,5+,6-/m0/s1
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n/an/a 1.22E+5n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of rat intestinal lactase assessed as production of p-nitrophenol by spectrophotometry


Bioorg Med Chem 19: 3558-68 (2011)


Article DOI: 10.1016/j.bmc.2011.04.011
BindingDB Entry DOI: 10.7270/Q2BC3ZWW
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50242267
PNG
(2,5-imino-1,2,5-trideoxy-D-mannitol | CHEMBL443158)
Show SMILES C[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(2-8)7-3/h3-10H,2H2,1H3/t3-,4-,5-,6-/m1/s1
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n/an/a 1.50E+5n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of bovine epididymis alpha-L-fucosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50360269
PNG
(CHEMBL1933097)
Show SMILES C[C@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H15NO3/c1-4-2-8-3-5(9)7(11)6(4)10/h4-11H,2-3H2,1H3/t4-,5+,6+,7+/m0/s1
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n/an/a 1.81E+5n/an/an/an/an/an/a



UMR CNRS 7201

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha-L-fucosidase


Bioorg Med Chem 20: 641-9 (2012)


Article DOI: 10.1016/j.bmc.2010.09.053
BindingDB Entry DOI: 10.7270/Q2GB24HJ
More data for this
Ligand-Target Pair
β-galactosidase


(Bos taurus (Bovine))
BDBM50360268
PNG
(CHEMBL1933098)
Show SMILES C[C@@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H15NO3/c1-4-2-8-3-5(9)7(11)6(4)10/h4-11H,2-3H2,1H3/t4-,5-,6-,7-/m1/s1
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n/an/a 1.98E+5n/an/an/an/an/an/a



UMR CNRS 7201

Curated by ChEMBL


Assay Description
Inhibition of bovine liver beta-galactosidase


Bioorg Med Chem 20: 641-9 (2012)


Article DOI: 10.1016/j.bmc.2010.09.053
BindingDB Entry DOI: 10.7270/Q2GB24HJ
More data for this
Ligand-Target Pair
alpha-Glucosidase (α-Glucosidase)


(Rattus norvegicus (Rat))
BDBM50350760
PNG
(CHEMBL1818436)
Show SMILES OC[C@@H]1NCC[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c8-3-4-6(10)5(9)1-2-7-4/h4-10H,1-3H2/t4-,5+,6-/m0/s1
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n/an/a 2.25E+5n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of rat intestinal sucrase assessed as production of p-nitrophenol at by spectrophotometry


Bioorg Med Chem 19: 3558-68 (2011)


Article DOI: 10.1016/j.bmc.2011.04.011
BindingDB Entry DOI: 10.7270/Q2BC3ZWW
More data for this
Ligand-Target Pair
Probable alpha-glucosidase Os06g0675700


(Oryza sativa subsp. japonica)
BDBM50360269
PNG
(CHEMBL1933097)
Show SMILES C[C@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H15NO3/c1-4-2-8-3-5(9)7(11)6(4)10/h4-11H,2-3H2,1H3/t4-,5+,6+,7+/m0/s1
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n/an/a 2.26E+5n/an/an/an/an/an/a



UMR CNRS 7201

Curated by ChEMBL


Assay Description
Inhibition of rice alpha-glucosidase


Bioorg Med Chem 20: 641-9 (2012)


Article DOI: 10.1016/j.bmc.2010.09.053
BindingDB Entry DOI: 10.7270/Q2GB24HJ
More data for this
Ligand-Target Pair
Glucosylceramidase


(Bos taurus)
BDBM50360268
PNG
(CHEMBL1933098)
Show SMILES C[C@@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H15NO3/c1-4-2-8-3-5(9)7(11)6(4)10/h4-11H,2-3H2,1H3/t4-,5-,6-,7-/m1/s1
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n/an/a 2.44E+5n/an/an/an/an/an/a



UMR CNRS 7201

Curated by ChEMBL


Assay Description
Inhibition of bovine liver beta-glucosidase


Bioorg Med Chem 20: 641-9 (2012)


Article DOI: 10.1016/j.bmc.2010.09.053
BindingDB Entry DOI: 10.7270/Q2GB24HJ
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50350760
PNG
(CHEMBL1818436)
Show SMILES OC[C@@H]1NCC[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c8-3-4-6(10)5(9)1-2-7-4/h4-10H,1-3H2/t4-,5+,6-/m0/s1
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n/an/a 2.60E+5n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of bovine epididymis alpha-L-fucosidase assessed as production of p-nitrophenol by spectrophotometry


Bioorg Med Chem 19: 3558-68 (2011)


Article DOI: 10.1016/j.bmc.2011.04.011
BindingDB Entry DOI: 10.7270/Q2BC3ZWW
More data for this
Ligand-Target Pair
β-galactosidase


(Bos taurus (Bovine))
BDBM50242268
PNG
(2,5-Imino-1,2,5-trideoxy-L-glucitol | CHEMBL502230)
Show SMILES C[C@H]1N[C@@H](CO)[C@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(2-8)7-3/h3-10H,2H2,1H3/t3-,4+,5+,6+/m1/s1
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n/an/a 4.20E+5n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of bovine liver beta-galactosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


Article DOI: 10.1021/np010360f
BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
β-galactosidase


(Bos taurus (Bovine))
BDBM50360269
PNG
(CHEMBL1933097)
Show SMILES C[C@H]1CNC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H15NO3/c1-4-2-8-3-5(9)7(11)6(4)10/h4-11H,2-3H2,1H3/t4-,5+,6+,7+/m0/s1
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n/an/a 8.76E+5n/an/an/an/an/an/a



UMR CNRS 7201

Curated by ChEMBL


Assay Description
Inhibition of bovine liver beta-galactosidase


Bioorg Med Chem 20: 641-9 (2012)


Article DOI: 10.1016/j.bmc.2010.09.053
BindingDB Entry DOI: 10.7270/Q2GB24HJ
More data for this
Ligand-Target Pair
β-galactosidase


(Bos taurus (Bovine))
BDBM50350760
PNG
(CHEMBL1818436)
Show SMILES OC[C@@H]1NCC[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO3/c8-3-4-6(10)5(9)1-2-7-4/h4-10H,1-3H2/t4-,5+,6-/m0/s1
KEGG

UniProtKB/SwissProt

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PubMed
n/an/a 9.60E+5n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of bovine liver beta-galactosidase assessed as production of p-nitrophenol by spectrophotometry


Bioorg Med Chem 19: 3558-68 (2011)


Article DOI: 10.1016/j.bmc.2011.04.011
BindingDB Entry DOI: 10.7270/Q2BC3ZWW
More data for this
Ligand-Target Pair
Alpha-fucosidase


(Bacteroides thetaiotaomicron)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
KEGG

UniProtKB/TrEMBL

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n/an/an/a 55.1n/an/an/a7.037



University of York



Assay Description
The kinetic studies involving a spectrophotometric product were conducted by monitoring the change in UV/visible absorbance with a Cintra 10 spectrop...


Chembiochem 11: 1971-4 (2010)


Article DOI: 10.1002/cbic.201000339
BindingDB Entry DOI: 10.7270/Q2N87898
More data for this
Ligand-Target Pair
Alpha-fucosidase


(Bacteroides thetaiotaomicron)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
KEGG

UniProtKB/TrEMBL

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n/an/an/a 27n/an/an/a6.537



University of York



Assay Description
The kinetic studies involving a spectrophotometric product were conducted by monitoring the change in UV/visible absorbance with a Cintra 10 spectrop...


Chembiochem 11: 1971-4 (2010)


Article DOI: 10.1002/cbic.201000339
BindingDB Entry DOI: 10.7270/Q2N87898
More data for this
Ligand-Target Pair
Alpha-fucosidase


(Bacteroides thetaiotaomicron)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
KEGG

UniProtKB/TrEMBL

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Article
PubMed
n/an/an/a 14.8n/an/an/a6.037



University of York



Assay Description
The kinetic studies involving a spectrophotometric product were conducted by monitoring the change in UV/visible absorbance with a Cintra 10 spectrop...


Chembiochem 11: 1971-4 (2010)


Article DOI: 10.1002/cbic.201000339
BindingDB Entry DOI: 10.7270/Q2N87898
More data for this
Ligand-Target Pair
Alpha-fucosidase


(Bacteroides thetaiotaomicron)
BDBM50065258
PNG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(8)2-7-3/h3-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1
KEGG

UniProtKB/TrEMBL

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n/an/an/a 372n/an/an/a8.537



University of York



Assay Description
The kinetic studies involving a spectrophotometric product were conducted by monitoring the change in UV/visible absorbance with a Cintra 10 spectrop...


Chembiochem 11: 1971-4 (2010)


Article DOI: 10.1002/cbic.201000339
BindingDB Entry DOI: 10.7270/Q2N87898
More data for this
Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB (change energy unit to kcal/mol)

Found 4 hits in this search
Cell (A)Syringe (B)Cell
Links
Syringe
Links
Cell + Syr
Links
ΔG°
kJ/mole
-TΔS°
kJ/mole
ΔH°
kJ/mole
log KpHTemp
°C
Alpha-fucosidase

(Bacteroides thetaiotaomicron)
BDBM50065258
JPEG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
GoogleScholar
MMDB
PC cid
PC sid
PDB
-44.80.222-42.7n/a6-236



University of York





Chembiochem 11: 1971-4 (2010)

Alpha-fucosidase

(Bacteroides thetaiotaomicron)
BDBM50065258
JPEG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
GoogleScholar
MMDB
PC cid
PC sid
PDB
-41.9-2.15-61.5n/a6.5-236



University of York





Chembiochem 11: 1971-4 (2010)

Alpha-fucosidase

(Bacteroides thetaiotaomicron)
BDBM50065258
JPEG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
GoogleScholar
MMDB
PC cid
PC sid
PDB
-41.9-2.85-65.3n/a6.5-236



University of York





Chembiochem 11: 1971-4 (2010)

Alpha-fucosidase

(Bacteroides thetaiotaomicron)
BDBM50065258
JPEG
((2S,3R,4S,5R)-2-Methyl-piperidine-3,4,5-triol | (2...)
GoogleScholar
MMDB
PC cid
PC sid
PDB
-37-2.37-56.1n/a6.5-236



University of York





Chembiochem 11: 1971-4 (2010)