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Compile Data Set for Download or QSAR

Found 15 hits of ph data with Target = 'Glucosamine-6- Phosphate Synthase'   
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
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85322
PNG
(GlcN-6-P synthase inhibitor, 15 (racemic mixture))
Show SMILES CCN(CC)S(=O)(=O)CCC(N)C(=O)OC
Show InChI InChI=1S/C9H20N2O4S/c1-4-11(5-2)16(13,14)7-6-8(10)9(12)15-3/h8H,4-7,10H2,1-3H3
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UniChem
6.00E+5n/a 1.60E+6n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85312
PNG
(GlcN-6-P synthase inhibitor, 5 (racemic mixture))
Show SMILES COP(O)(=O)CCC(N)C(O)=O
Show InChI InChI=1S/C5H12NO5P/c1-11-12(9,10)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10)
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9.00E+5n/a 2.00E+6n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85316
PNG
(GlcN-6-P synthase inhibitor, 9 (racemic mixture))
Show SMILES CCN(CC)P(=O)(CCC(N)C(=O)OC)OC
Show InChI InChI=1S/C10H23N2O4P/c1-5-12(6-2)17(14,16-4)8-7-9(11)10(13)15-3/h9H,5-8,11H2,1-4H3
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UniChem

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9.40E+5n/a 3.60E+6n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85311
PNG
(GlcN-6-P synthase inhibitor, 4 (racemic mixture))
Show SMILES COC(=O)C(N)CCP(O)(=O)OC
Show InChI InChI=1S/C6H14NO5P/c1-11-6(8)5(7)3-4-13(9,10)12-2/h5H,3-4,7H2,1-2H3,(H,9,10)
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UniChem

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1.20E+6n/a 2.60E+6n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85315
PNG
(GlcN-6-P synthase inhibitor, 8 (racemic mixture))
Show SMILES COC(=O)C(N)CCP(=O)(OC)N(C)C
Show InChI InChI=1S/C8H19N2O4P/c1-10(2)15(12,14-4)6-5-7(9)8(11)13-3/h7H,5-6,9H2,1-4H3
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UniChem

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1.30E+6n/a 4.40E+6n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85320
PNG
(GlcN-6-P synthase inhibitor, 13 (racemic mixture))
Show SMILES COC(=O)C(N)CCS(C)(=N)=O
Show InChI InChI=1S/C6H15N2O3S/c1-11-6(9)5(7)3-4-12(2,8)10/h5H,3-4,7H2,1-2H3,(H2,8,10)/q-1
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1.50E+6n/a 2.80E+6n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85321
PNG
(GlcN-6-P synthase inhibitor, 14 (racemic mixture))
Show SMILES COC(=O)C(N)CCS(N)(=O)=O
Show InChI InChI=1S/C5H12N2O4S/c1-11-5(8)4(6)2-3-12(7,9)10/h4H,2-3,6H2,1H3,(H2,7,9,10)
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2.80E+6n/a 5.50E+6n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85314
PNG
(GlcN-6-P synthase inhibitor, 7 (racemic mixture))
Show SMILES CCNP(=O)(CCC(N)C(=O)OC)OC
Show InChI InChI=1S/C8H19N2O4P/c1-4-10-15(12,14-3)6-5-7(9)8(11)13-2/h7H,4-6,9H2,1-3H3,(H,10,12)
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4.40E+6n/a 7.80E+6n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85313
PNG
(GlcN-6-P synthase inhibitor, 6 (racemic mixture))
Show SMILES COC(=O)C(N)CCP(N)(=O)OC
Show InChI InChI=1S/C6H15N2O4P/c1-11-6(9)5(7)3-4-13(8,10)12-2/h5H,3-4,7H2,1-2H3,(H2,8,10)
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1.10E+7n/a 2.50E+7n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM50004051
PNG
(2-Amino-4-phosphono-butyric acid | 2-Amino-4-phosp...)
Show SMILES NC(CCP(O)(O)=O)C(O)=O
Show InChI InChI=1S/C4H10NO5P/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H2,8,9,10)
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UniChem

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1.20E+7n/a 2.60E+7n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85310
PNG
(GlcN-6-P synthase inhibitor, 3 (racemic mixture))
Show SMILES COP(=O)(CCC(N)C(O)=O)OC
Show InChI InChI=1S/C6H14NO5P/c1-11-13(10,12-2)4-3-5(7)6(8)9/h5H,3-4,7H2,1-2H3,(H,8,9)
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UniChem

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n/an/a>5.00E+7n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85317
PNG
(GlcN-6-P synthase inhibitor, 10 (racemic mixture))
Show SMILES COC(=O)C(N)CC[S-](=O)=O
Show InChI InChI=1S/C5H10NO4S/c1-10-5(7)4(6)2-3-11(8)9/h4H,2-3,6H2,1H3/q-1
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PC cid
PC sid
UniChem

Similars

n/an/a>5.00E+7n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85318
PNG
(GlcN-6-P synthase inhibitor, 11 (racemic mixture))
Show SMILES COC(=O)C(N)CCS(C)(=O)=O
Show InChI InChI=1S/C6H13NO4S/c1-11-6(8)5(7)3-4-12(2,9)10/h5H,3-4,7H2,1-2H3
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n/an/a>5.00E+7n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85319
PNG
(GlcN-6-P synthase inhibitor, 12 (racemic mixture))
Show SMILES COC(=O)C(N)CNS(C)(=O)=O
Show InChI InChI=1S/C5H12N2O4S/c1-11-5(8)4(6)3-7-12(2,9)10/h4,7H,3,6H2,1-2H3
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n/an/a>5.00E+7n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair
Glucosamine-6- Phosphate Synthase


(Candida albicans)
BDBM85309
PNG
(GlcN-6-P synthase inhibitor, 2 (racemic mixture))
Show SMILES COC(=O)C(N)CCP(=O)(OC)OC
Show InChI InChI=1S/C7H16NO5P/c1-11-7(9)6(8)4-5-14(10,12-2)13-3/h6H,4-5,8H2,1-3H3
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n/an/a>5.00E+7n/an/an/an/a6.85n/a



Technical University of Gdansk



Assay Description
Two assays of GlcN-6-P synthase activity were used 1)determination of GlcN-6_P formation by the modified Elson-Morgan procedure and 2) continuous qua...


Bioorg Chem 25: 283-296 (1997)


BindingDB Entry DOI: 10.7270/Q2RB7351
More data for this
Ligand-Target Pair