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Compile Data Set for Download or QSAR

Found 27 hits of ki data for polymerid = 50003017   
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 1


(Bos taurus)
BDBM50179482
PNG
((2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-methylpiperidi...)
Show SMILES C[C@@H]1N[C@@H]([C@@H](O)[C@H](O)[C@@H]1O)S(O)(=O)=O
Show InChI InChI=1S/C6H13NO6S/c1-2-3(8)4(9)5(10)6(7-2)14(11,12)13/h2-10H,1H3,(H,11,12,13)/t2-,3+,4+,5-,6+/m0/s1
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1n/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)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50179481
PNG
(CHEMBL203969 | L-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?/m0/s1
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1n/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)

More data for this
Ligand-Target Pair
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)

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)

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)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50065257
PNG
((2R,3R,4R,5R,6S)-2-Hydroxymethyl-6-methyl-piperidi...)
Show SMILES C[C@@H]1N[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C7H15NO4/c1-3-5(10)7(12)6(11)4(2-9)8-3/h3-12H,2H2,1H3/t3-,4+,5+,6+,7+/m0/s1
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5.30n/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)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50065257
PNG
((2R,3R,4R,5R,6S)-2-Hydroxymethyl-6-methyl-piperidi...)
Show SMILES C[C@@H]1N[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C7H15NO4/c1-3-5(10)7(12)6(11)4(2-9)8-3/h3-12H,2H2,1H3/t3-,4+,5+,6+,7+/m0/s1
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5.30n/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


Citation and Details
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)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50242272
PNG
(6-O-alpha-rhamnopyranosyl-DMJ | CHEMBL469655)
Show SMILES C[C@H]1O[C@H](OC[C@H]2NC[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H23NO8/c1-4-7(15)10(18)11(19)12(21-4)20-3-5-8(16)9(17)6(14)2-13-5/h4-19H,2-3H2,1H3/t4-,5-,6-,7-,8-,9-,10+,11+,12+/m1/s1
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60n/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


Citation and Details
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50163439
PNG
((2S,3R,4S,5R)-2-Hydroxymethyl-piperidine-3,4,5-tri...)
Show SMILES OC[C@@H]1NC[C@@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4+,5+,6-/m0/s1
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80n/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)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50369362
PNG
(CHEMBL1169500)
Show SMILES OC[C@H]1N[C@H](CO)[C@H](O)C(O)[C@H]1O
Show InChI InChI=1S/C7H15NO5/c9-1-3-5(11)7(13)6(12)4(2-10)8-3/h3-13H,1-2H2/t3-,4-,5+,6+/m1/s1
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450n/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)

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


Citation and Details
More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50321922
PNG
((3S,4S,5R,6S)-3-(p-Phenylbenzoylaminomethyl)-6-met...)
Show SMILES C[C@@H]1NN[C@@H](CNC(=O)c2ccc(cc2)-c2ccccc2)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C19H23N3O3/c1-12-17(23)18(24)16(22-21-12)11-20-19(25)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10,12,16-18,21-24H,11H2,1H3,(H,20,25)/t12-,16-,17+,18-/m0/s1
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1.00E+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)

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)

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)

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)

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)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50065259
PNG
((2R,3R,4R,5R)-2-(Hydroxymethyl)piperidine-3,4,5-tr...)
Show SMILES OC[C@H]1NC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4-,5-,6-/m1/s1
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4.70E+3n/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)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50179479
PNG
((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylpiperidi...)
Show SMILES C[C@H]1N[C@H]([C@H](O)[C@@H](O)[C@H]1O)S(O)(=O)=O
Show InChI InChI=1S/C6H13NO6S/c1-2-3(8)4(9)5(10)6(7-2)14(11,12)13/h2-10H,1H3,(H,11,12,13)/t2-,3+,4+,5-,6+/m1/s1
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1.30E+4n/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)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50163446
PNG
((2S,3R,4R,5R)-2-Hydroxymethyl-piperidine-3,4,5-tri...)
Show SMILES OC[C@@H]1NC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4+,5+,6+/m0/s1
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1.40E+4n/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)

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)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50186733
PNG
(CHEMBL208152 | L-1,4,6-trideoxy-4,4-difluoronojiri...)
Show SMILES C[C@@H]1NC[C@@H](O)[C@H](O)C1(F)F
Show InChI InChI=1S/C6H11F2NO2/c1-3-6(7,8)5(11)4(10)2-9-3/h3-5,9-11H,2H2,1H3/t3-,4+,5-/m0/s1
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5.70E+5n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha fucosidase at pH 6.8


J Med Chem 49: 2989-97 (2006)

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)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50186732
PNG
(CHEMBL206628 | D-1,4,6-trideoxy-4,4-difluoronojiri...)
Show SMILES C[C@H]1NC[C@H](O)[C@@H](O)C1(F)F
Show InChI InChI=1S/C6H11F2NO2/c1-3-6(7,8)5(11)4(10)2-9-3/h3-5,9-11H,2H2,1H3/t3-,4+,5-/m1/s1
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>1.00E+6n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha fucosidase at pH 6.8


J Med Chem 49: 2989-97 (2006)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50186736
PNG
(CHEMBL380311 | L-1,4-dideoxy-4,4-difluorogulonojir...)
Show SMILES OC[C@@H]1NC[C@@H](O)[C@@H](O)C1(F)F
Show InChI InChI=1S/C6H11F2NO3/c7-6(8)4(2-10)9-1-3(11)5(6)12/h3-5,9-12H,1-2H2/t3-,4+,5-/m1/s1
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>1.00E+6n/an/an/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha fucosidase at pH 6.8


J Med Chem 49: 2989-97 (2006)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50186734
PNG
(CHEMBL207910 | D-1,4-dideoxy-4,4-difluoronojirimyc...)
Show SMILES OC[C@H]1NC[C@H](O)[C@@H](O)C1(F)F
Show InChI InChI=1S/C6H11F2NO3/c7-6(8)4(2-10)9-1-3(11)5(6)12/h3-5,9-12H,1-2H2/t3-,4+,5+/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha fucosidase at pH 6.8


J Med Chem 49: 2989-97 (2006)

More data for this
Ligand-Target Pair
Alpha-L-fucosidase 1


(Bos taurus)
BDBM50186735
PNG
(CHEMBL208021 | D-1,4-dideoxy-4,4-difluoromannonoji...)
Show SMILES OC[C@H]1NC[C@@H](O)[C@@H](O)C1(F)F
Show InChI InChI=1S/C6H11F2NO3/c7-6(8)4(2-10)9-1-3(11)5(6)12/h3-5,9-12H,1-2H2/t3-,4-,5-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of bovine kidney alpha fucosidase at pH 6.8


J Med Chem 49: 2989-97 (2006)

More data for this
Ligand-Target Pair