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PubMed code 25254502

Compile data set for download or QSAR
Found 27 hits of Enzyme Inhibition Constant Data   
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
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028362
PNG
(CHEMBL3341763)
Show SMILES COc1ccc(cc1)C(CCC(=O)N(C)O)P(O)(O)=O
Show InChI InChI=1S/C12H18NO6P/c1-13(15)12(14)8-7-11(20(16,17)18)9-3-5-10(19-2)6-4-9/h3-6,11,15H,7-8H2,1-2H3,(H2,16,17,18)
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n/an/a 70n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028363
PNG
(CHEMBL3342259)
Show SMILES COc1ccc(cc1)C(CCC(=O)NO)P(O)(O)=O
Show InChI InChI=1S/C11H16NO6P/c1-18-9-4-2-8(3-5-9)10(19(15,16)17)6-7-11(13)12-14/h2-5,10,14H,6-7H2,1H3,(H,12,13)(H2,15,16,17)
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n/an/a 140n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028309
PNG
(Fosmidomycin Sodium)
Show SMILES [Na+].ON(CCCP(O)([O-])=O)C=O
Show InChI InChI=1S/C4H10NO5P.Na/c6-4-5(7)2-1-3-11(8,9)10;/h4,7H,1-3H2,(H2,8,9,10);/q;+1/p-1
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n/an/a 220n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50441193
PNG
(CHEMBL2164256)
Show SMILES CN(O)C(=O)CCC(c1ccc(C)cc1)P(O)(O)=O
Show InChI InChI=1S/C12H18NO5P/c1-9-3-5-10(6-4-9)11(19(16,17)18)7-8-12(14)13(2)15/h3-6,11,15H,7-8H2,1-2H3,(H2,16,17,18)
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n/an/a 290n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028364
PNG
(CHEMBL3342260)
Show SMILES COc1ccc(cc1OC)C(CCC(=O)N(C)O)P(O)(O)=O
Show InChI InChI=1S/C13H20NO7P/c1-14(16)13(15)7-6-12(22(17,18)19)9-4-5-10(20-2)11(8-9)21-3/h4-5,8,12,16H,6-7H2,1-3H3,(H2,17,18,19)
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n/an/a 320n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028373
PNG
(CHEMBL3342262)
Show SMILES COc1ccc(cc1)C(OCC(=O)N(C)O)P(O)(O)=O
Show InChI InChI=1S/C11H16NO7P/c1-12(14)10(13)7-19-11(20(15,16)17)8-3-5-9(18-2)6-4-8/h3-6,11,14H,7H2,1-2H3,(H2,15,16,17)
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Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028310
PNG
(CHEMBL3342258)
Show SMILES Cc1ccc(cc1)C(CCC(=O)NO)P(O)(O)=O
Show InChI InChI=1S/C11H16NO5P/c1-8-2-4-9(5-3-8)10(18(15,16)17)6-7-11(13)12-14/h2-5,10,14H,6-7H2,1H3,(H,12,13)(H2,15,16,17)
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n/an/a 700n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028371
PNG
(CHEMBL3342261)
Show SMILES COc1ccc(cc1OC)C(CCC(=O)NO)P(O)(O)=O
Show InChI InChI=1S/C12H18NO7P/c1-19-9-4-3-8(7-10(9)20-2)11(21(16,17)18)5-6-12(14)13-15/h3-4,7,11,15H,5-6H2,1-2H3,(H,13,14)(H2,16,17,18)
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n/an/a 1.50E+3n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441193
PNG
(CHEMBL2164256)
Show SMILES CN(O)C(=O)CCC(c1ccc(C)cc1)P(O)(O)=O
Show InChI InChI=1S/C12H18NO5P/c1-9-3-5-10(6-4-9)11(19(16,17)18)7-8-12(14)13(2)15/h3-6,11,15H,7-8H2,1-2H3,(H2,16,17,18)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028362
PNG
(CHEMBL3341763)
Show SMILES COc1ccc(cc1)C(CCC(=O)N(C)O)P(O)(O)=O
Show InChI InChI=1S/C12H18NO6P/c1-13(15)12(14)8-7-11(20(16,17)18)9-3-5-10(19-2)6-4-9/h3-6,11,15H,7-8H2,1-2H3,(H2,16,17,18)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028373
PNG
(CHEMBL3342262)
Show SMILES COc1ccc(cc1)C(OCC(=O)N(C)O)P(O)(O)=O
Show InChI InChI=1S/C11H16NO7P/c1-12(14)10(13)7-19-11(20(15,16)17)8-3-5-9(18-2)6-4-8/h3-6,11,14H,7H2,1-2H3,(H2,15,16,17)
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n/an/a 2.80E+3n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028380
PNG
(CHEMBL3342264)
Show SMILES CN(O)C(=O)CCCC(c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C12H18NO5P/c1-13(15)12(14)9-5-8-11(19(16,17)18)10-6-3-2-4-7-10/h2-4,6-7,11,15H,5,8-9H2,1H3,(H2,16,17,18)
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n/an/a 4.30E+3n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028381
PNG
(CHEMBL3342265)
Show SMILES CN(O)C(=O)CCC(NC(=O)c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C12H17N2O6P/c1-14(17)11(15)8-7-10(21(18,19)20)13-12(16)9-5-3-2-4-6-9/h2-6,10,17H,7-8H2,1H3,(H,13,16)(H2,18,19,20)
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n/an/a 1.10E+4n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028310
PNG
(CHEMBL3342258)
Show SMILES Cc1ccc(cc1)C(CCC(=O)NO)P(O)(O)=O
Show InChI InChI=1S/C11H16NO5P/c1-8-2-4-9(5-3-8)10(18(15,16)17)6-7-11(13)12-14/h2-5,10,14H,6-7H2,1H3,(H,12,13)(H2,15,16,17)
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Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028363
PNG
(CHEMBL3342259)
Show SMILES COc1ccc(cc1)C(CCC(=O)NO)P(O)(O)=O
Show InChI InChI=1S/C11H16NO6P/c1-18-9-4-2-8(3-5-9)10(19(15,16)17)6-7-11(13)12-14/h2-5,10,14H,6-7H2,1H3,(H,12,13)(H2,15,16,17)
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n/an/a 1.50E+4n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028379
PNG
(CHEMBL3342263)
Show SMILES COc1ccc(cc1)C(OCC(=O)NO)P(O)(O)=O
Show InChI InChI=1S/C10H14NO7P/c1-17-8-4-2-7(3-5-8)10(19(14,15)16)18-6-9(12)11-13/h2-5,10,13H,6H2,1H3,(H,11,12)(H2,14,15,16)
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n/an/a 1.70E+4n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028364
PNG
(CHEMBL3342260)
Show SMILES COc1ccc(cc1OC)C(CCC(=O)N(C)O)P(O)(O)=O
Show InChI InChI=1S/C13H20NO7P/c1-14(16)13(15)7-6-12(22(17,18)19)9-4-5-10(20-2)11(8-9)21-3/h4-5,8,12,16H,6-7H2,1-3H3,(H2,17,18,19)
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n/an/a 2.90E+4n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028371
PNG
(CHEMBL3342261)
Show SMILES COc1ccc(cc1OC)C(CCC(=O)NO)P(O)(O)=O
Show InChI InChI=1S/C12H18NO7P/c1-19-9-4-3-8(7-10(9)20-2)11(21(16,17)18)5-6-12(14)13-15/h3-4,7,11,15H,5-6H2,1-2H3,(H,13,14)(H2,16,17,18)
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n/an/a 1.63E+5n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028381
PNG
(CHEMBL3342265)
Show SMILES CN(O)C(=O)CCC(NC(=O)c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C12H17N2O6P/c1-14(17)11(15)8-7-10(21(18,19)20)13-12(16)9-5-3-2-4-6-9/h2-6,10,17H,7-8H2,1H3,(H,13,16)(H2,18,19,20)
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n/an/a 2.38E+5n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028379
PNG
(CHEMBL3342263)
Show SMILES COc1ccc(cc1)C(OCC(=O)NO)P(O)(O)=O
Show InChI InChI=1S/C10H14NO7P/c1-17-8-4-2-7(3-5-8)10(19(14,15)16)18-6-9(12)11-13/h2-5,10,13H,6H2,1H3,(H,11,12)(H2,14,15,16)
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n/an/a 3.52E+5n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028380
PNG
(CHEMBL3342264)
Show SMILES CN(O)C(=O)CCCC(c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C12H18NO5P/c1-13(15)12(14)9-5-8-11(19(16,17)18)10-6-3-2-4-7-10/h2-4,6-7,11,15H,5,8-9H2,1H3,(H2,16,17,18)
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n/an/a 4.29E+5n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028384
PNG
(CHEMBL3342268)
Show SMILES OP(O)(=O)CCC(c1cccc2ccccc12)P(O)(O)=O
Show InChI InChI=1S/C13H16O6P2/c14-20(15,16)9-8-13(21(17,18)19)12-7-3-5-10-4-1-2-6-11(10)12/h1-7,13H,8-9H2,(H2,14,15,16)(H2,17,18,19)
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n/an/a>5.00E+5n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028383
PNG
(CHEMBL3342267)
Show SMILES Oc1ccccc1NC(=O)CCC(c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C16H18NO5P/c18-14-9-5-4-8-13(14)17-16(19)11-10-15(23(20,21)22)12-6-2-1-3-7-12/h1-9,15,18H,10-11H2,(H,17,19)(H2,20,21,22)
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n/an/a>5.00E+5n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028383
PNG
(CHEMBL3342267)
Show SMILES Oc1ccccc1NC(=O)CCC(c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C16H18NO5P/c18-14-9-5-4-8-13(14)17-16(19)11-10-15(23(20,21)22)12-6-2-1-3-7-12/h1-9,15,18H,10-11H2,(H,17,19)(H2,20,21,22)
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n/an/a>5.00E+5n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028384
PNG
(CHEMBL3342268)
Show SMILES OP(O)(=O)CCC(c1cccc2ccccc12)P(O)(O)=O
Show InChI InChI=1S/C13H16O6P2/c14-20(15,16)9-8-13(21(17,18)19)12-7-3-5-10-4-1-2-6-11(10)12/h1-7,13H,8-9H2,(H2,14,15,16)(H2,17,18,19)
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n/an/a>5.00E+5n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Escherichia coli)		BDBM50028382
PNG
(CHEMBL3342266)
Show SMILES ONC(=O)CCC(NC(=O)c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C11H15N2O6P/c14-9(13-16)6-7-10(20(17,18)19)12-11(15)8-4-2-1-3-5-8/h1-5,10,16H,6-7H2,(H,12,15)(H,13,14)(H2,17,18,19)
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Article
PubMed
n/an/a 7.41E+5n/an/an/an/an/an/a



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli M15 recombinant IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50028382
PNG
(CHEMBL3342266)
Show SMILES ONC(=O)CCC(NC(=O)c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C11H15N2O6P/c14-9(13-16)6-7-10(20(17,18)19)12-11(15)8-4-2-1-3-5-8/h1-5,10,16H,6-7H2,(H,12,15)(H,13,14)(H2,17,18,19)
PDB
MMDB

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



Heinrich Heine Universit£t

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC using 1-deoxy-D-xylulose 5-phosphate as substrate by photometric analysis

J Med Chem 57: 8827-38 (2014)


Article DOI: 10.1021/jm500850y
BindingDB Entry DOI: 10.7270/Q2KP83RX
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%