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Found 18 hits Enz. Inhib. hit(s) with Target = 'Nicotinate-nucleotide adenylyltransferase (NadD)' AND taxid = 83333   
Target
(Institution)
LigandTarget
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
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM50318652
PNG
((E)-4-(2-(anthracen-9-ylmethylene)hydrazinyl)-N-(3...)
Show SMILES Clc1cccc(NC(=O)CCC(=O)N\N=C\c2c3ccccc3cc3ccccc23)c1
Show InChI InChI=1S/C25H20ClN3O2/c26-19-8-5-9-20(15-19)28-24(30)12-13-25(31)29-27-16-23-21-10-3-1-6-17(21)14-18-7-2-4-11-22(18)23/h1-11,14-16H,12-13H2,(H,28,30)(H,29,31)/b27-16+
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5.00E+3n/an/an/an/an/an/an/an/a



Burnham Institute for Medical Research



Assay Description
The enzymatic assay was masured at fixed NaMN and ATP concentration (equal to two-fold km values)with various concentration of inhibitory compounds.


Chem Biol 16: 849-61 (2009)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM50318652
PNG
((E)-4-(2-(anthracen-9-ylmethylene)hydrazinyl)-N-(3...)
Show SMILES Clc1cccc(NC(=O)CCC(=O)N\N=C\c2c3ccccc3cc3ccccc23)c1
Show InChI InChI=1S/C25H20ClN3O2/c26-19-8-5-9-20(15-19)28-24(30)12-13-25(31)29-27-16-23-21-10-3-1-6-17(21)14-18-7-2-4-11-22(18)23/h1-11,14-16H,12-13H2,(H,28,30)(H,29,31)/b27-16+
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8.00E+3n/a 1.50E+4n/an/an/an/an/an/a



Burnham Institute for Medical Research



Assay Description
The enzymatic assay was masured at fixed NaMN and ATP concentration (equal to two-fold km values)with various concentration of inhibitory compounds.


Chem Biol 16: 849-61 (2009)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM50318653
PNG
(3-amino-N-(3-fluorophenyl)-6-(thiophen-2-yl)thieno...)
Show SMILES Nc1c(sc2nc(ccc12)-c1cccs1)C(=O)Nc1cccc(F)c1
Show InChI InChI=1S/C18H12FN3OS2/c19-10-3-1-4-11(9-10)21-17(23)16-15(20)12-6-7-13(22-18(12)25-16)14-5-2-8-24-14/h1-9H,20H2,(H,21,23)
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2.10E+4n/an/an/an/an/an/an/an/a



Burnham Institute for Medical Research



Assay Description
The enzymatic assay was masured at fixed NaMN and ATP concentration (equal to two-fold km values)with various concentration of inhibitory compounds.


Chem Biol 16: 849-61 (2009)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM50318653
PNG
(3-amino-N-(3-fluorophenyl)-6-(thiophen-2-yl)thieno...)
Show SMILES Nc1c(sc2nc(ccc12)-c1cccs1)C(=O)Nc1cccc(F)c1
Show InChI InChI=1S/C18H12FN3OS2/c19-10-3-1-4-11(9-10)21-17(23)16-15(20)12-6-7-13(22-18(12)25-16)14-5-2-8-24-14/h1-9H,20H2,(H,21,23)
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2.50E+4n/a 6.50E+4n/an/an/an/an/an/a



Burnham Institute for Medical Research



Assay Description
The enzymatic assay was masured at fixed NaMN and ATP concentration (equal to two-fold km values)with various concentration of inhibitory compounds.


Chem Biol 16: 849-61 (2009)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM50318652
PNG
((E)-4-(2-(anthracen-9-ylmethylene)hydrazinyl)-N-(3...)
Show SMILES Clc1cccc(NC(=O)CCC(=O)N\N=C\c2c3ccccc3cc3ccccc23)c1
Show InChI InChI=1S/C25H20ClN3O2/c26-19-8-5-9-20(15-19)28-24(30)12-13-25(31)29-27-16-23-21-10-3-1-6-17(21)14-18-7-2-4-11-22(18)23/h1-11,14-16H,12-13H2,(H,28,30)(H,29,31)/b27-16+
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US Patent
n/an/a 1.50E+4n/an/an/an/an/an/a



University of Maryland, Baltimore; The Board of Regents of the University of Texas System; Sanford-Burnham Medical Research Institute

US Patent


Assay Description
A general phosphate detection assay method using Malachite Green reagent was adapted to measure the activity of NaMN adenylyltransferaseA14. Briefly,...


US Patent US8785499 (2014)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81359
PNG
(NadD inhibitor 1_03 | US8785499, 1_03)
Show SMILES Brc1ccc(NC(=O)CCCC(=O)N\N=C\c2c3ccccc3cc3ccccc23)cc1
Show InChI InChI=1S/C26H22BrN3O2/c27-20-12-14-21(15-13-20)29-25(31)10-5-11-26(32)30-28-17-24-22-8-3-1-6-18(22)16-19-7-2-4-9-23(19)24/h1-4,6-9,12-17H,5,10-11H2,(H,29,31)(H,30,32)/b28-17+
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n/an/a 1.80E+4n/an/an/an/an/an/a



University of Maryland, Baltimore; The Board of Regents of the University of Texas System; Sanford-Burnham Medical Research Institute

US Patent


Assay Description
A general phosphate detection assay method using Malachite Green reagent was adapted to measure the activity of NaMN adenylyltransferaseA14. Briefly,...


US Patent US8785499 (2014)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81359
PNG
(NadD inhibitor 1_03 | US8785499, 1_03)
Show SMILES Brc1ccc(NC(=O)CCCC(=O)N\N=C\c2c3ccccc3cc3ccccc23)cc1
Show InChI InChI=1S/C26H22BrN3O2/c27-20-12-14-21(15-13-20)29-25(31)10-5-11-26(32)30-28-17-24-22-8-3-1-6-18(22)16-19-7-2-4-9-23(19)24/h1-4,6-9,12-17H,5,10-11H2,(H,29,31)(H,30,32)/b28-17+
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n/an/a 1.80E+4n/an/an/an/an/an/a



Burnham Institute for Medical Research



Assay Description
The enzymatic assay was masured at fixed NaMN and ATP concentration (equal to two-fold km values)with various concentration of inhibitory compounds.


Chem Biol 16: 849-61 (2009)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81357
PNG
(NadD inhibitor 3_05 | US8785499, 3_05)
Show SMILES Nc1c(sc2nc(ccc12)-c1cccs1)C(=O)Nc1cc(Cl)ccc1Cl
Show InChI InChI=1S/C18H11Cl2N3OS2/c19-9-3-5-11(20)13(8-9)22-17(24)16-15(21)10-4-6-12(23-18(10)26-16)14-2-1-7-25-14/h1-8H,21H2,(H,22,24)
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n/an/a 2.00E+4n/an/an/an/an/an/a



Burnham Institute for Medical Research



Assay Description
The enzymatic assay was masured at fixed NaMN and ATP concentration (equal to two-fold km values)with various concentration of inhibitory compounds.


Chem Biol 16: 849-61 (2009)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81357
PNG
(NadD inhibitor 3_05 | US8785499, 3_05)
Show SMILES Nc1c(sc2nc(ccc12)-c1cccs1)C(=O)Nc1cc(Cl)ccc1Cl
Show InChI InChI=1S/C18H11Cl2N3OS2/c19-9-3-5-11(20)13(8-9)22-17(24)16-15(21)10-4-6-12(23-18(10)26-16)14-2-1-7-25-14/h1-8H,21H2,(H,22,24)
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n/an/a 2.00E+4n/an/an/an/an/an/a



University of Maryland, Baltimore; The Board of Regents of the University of Texas System; Sanford-Burnham Medical Research Institute

US Patent


Assay Description
A general phosphate detection assay method using Malachite Green reagent was adapted to measure the activity of NaMN adenylyltransferaseA14. Briefly,...


US Patent US8785499 (2014)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81358
PNG
(NadD inhibitor 3_15 | US8785499, 3_15)
Show SMILES Nc1c(sc2nc(ccc12)-c1cccs1)C(=O)Nc1ccc(Cl)cc1F
Show InChI InChI=1S/C18H11ClFN3OS2/c19-9-3-5-12(11(20)8-9)22-17(24)16-15(21)10-4-6-13(23-18(10)26-16)14-2-1-7-25-14/h1-8H,21H2,(H,22,24)
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n/an/a 5.10E+4n/an/an/an/an/an/a



Burnham Institute for Medical Research



Assay Description
The enzymatic assay was masured at fixed NaMN and ATP concentration (equal to two-fold km values)with various concentration of inhibitory compounds.


Chem Biol 16: 849-61 (2009)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81358
PNG
(NadD inhibitor 3_15 | US8785499, 3_15)
Show SMILES Nc1c(sc2nc(ccc12)-c1cccs1)C(=O)Nc1ccc(Cl)cc1F
Show InChI InChI=1S/C18H11ClFN3OS2/c19-9-3-5-12(11(20)8-9)22-17(24)16-15(21)10-4-6-13(23-18(10)26-16)14-2-1-7-25-14/h1-8H,21H2,(H,22,24)
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US Patent
n/an/a 5.10E+4n/an/an/an/an/an/a



University of Maryland, Baltimore; The Board of Regents of the University of Texas System; Sanford-Burnham Medical Research Institute

US Patent


Assay Description
A general phosphate detection assay method using Malachite Green reagent was adapted to measure the activity of NaMN adenylyltransferaseA14. Briefly,...


US Patent US8785499 (2014)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM50318653
PNG
(3-amino-N-(3-fluorophenyl)-6-(thiophen-2-yl)thieno...)
Show SMILES Nc1c(sc2nc(ccc12)-c1cccs1)C(=O)Nc1cccc(F)c1
Show InChI InChI=1S/C18H12FN3OS2/c19-10-3-1-4-11(9-10)21-17(23)16-15(20)12-6-7-13(22-18(12)25-16)14-5-2-8-24-14/h1-9H,20H2,(H,21,23)
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n/an/a 6.50E+4n/an/an/an/an/an/a



University of Maryland, Baltimore; The Board of Regents of the University of Texas System; Sanford-Burnham Medical Research Institute

US Patent


Assay Description
A general phosphate detection assay method using Malachite Green reagent was adapted to measure the activity of NaMN adenylyltransferaseA14. Briefly,...


US Patent US8785499 (2014)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81360
PNG
(NadD inhibitor 3_17 | US8785499, 3_17)
Show SMILES Nc1c(sc2nc(ccc12)-c1ccncc1)C(=O)Nc1cccc(Cl)c1
Show InChI InChI=1S/C19H13ClN4OS/c20-12-2-1-3-13(10-12)23-18(25)17-16(21)14-4-5-15(24-19(14)26-17)11-6-8-22-9-7-11/h1-10H,21H2,(H,23,25)
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n/an/a 1.70E+5n/an/an/an/an/an/a



Burnham Institute for Medical Research



Assay Description
The enzymatic assay was masured at fixed NaMN and ATP concentration (equal to two-fold km values)with various concentration of inhibitory compounds.


Chem Biol 16: 849-61 (2009)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81360
PNG
(NadD inhibitor 3_17 | US8785499, 3_17)
Show SMILES Nc1c(sc2nc(ccc12)-c1ccncc1)C(=O)Nc1cccc(Cl)c1
Show InChI InChI=1S/C19H13ClN4OS/c20-12-2-1-3-13(10-12)23-18(25)17-16(21)14-4-5-15(24-19(14)26-17)11-6-8-22-9-7-11/h1-10H,21H2,(H,23,25)
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n/an/a 1.70E+5n/an/an/an/an/an/a



University of Maryland, Baltimore; The Board of Regents of the University of Texas System; Sanford-Burnham Medical Research Institute

US Patent


Assay Description
A general phosphate detection assay method using Malachite Green reagent was adapted to measure the activity of NaMN adenylyltransferaseA14. Briefly,...


US Patent US8785499 (2014)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81362
PNG
(NadD inhibitor 15_11 | US8785499, 15_11)
Show SMILES COC(=O)c1ccc(cc1)N=CC1C(=O)Nc2ccccc12
Show InChI InChI=1S/C17H14N2O3/c1-22-17(21)11-6-8-12(9-7-11)18-10-14-13-4-2-3-5-15(13)19-16(14)20/h2-10,14H,1H3,(H,19,20)
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n/an/a 1.91E+5n/an/an/an/an/an/a



Burnham Institute for Medical Research



Assay Description
The enzymatic assay was masured at fixed NaMN and ATP concentration (equal to two-fold km values)with various concentration of inhibitory compounds.


Chem Biol 16: 849-61 (2009)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81362
PNG
(NadD inhibitor 15_11 | US8785499, 15_11)
Show SMILES COC(=O)c1ccc(cc1)N=CC1C(=O)Nc2ccccc12
Show InChI InChI=1S/C17H14N2O3/c1-22-17(21)11-6-8-12(9-7-11)18-10-14-13-4-2-3-5-15(13)19-16(14)20/h2-10,14H,1H3,(H,19,20)
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n/an/a 1.91E+5n/an/an/an/an/an/a



University of Maryland, Baltimore; The Board of Regents of the University of Texas System; Sanford-Burnham Medical Research Institute

US Patent


Assay Description
A general phosphate detection assay method using Malachite Green reagent was adapted to measure the activity of NaMN adenylyltransferaseA14. Briefly,...


US Patent US8785499 (2014)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81361
PNG
(NadD inhibitor 3_23 | US8785499, 3_23)
Show SMILES Nc1c(sc2nc(ccc12)-c1ccc(F)cc1)C(=O)Nc1ccc(F)cc1Cl
Show InChI InChI=1S/C20H12ClF2N3OS/c21-14-9-12(23)5-7-16(14)25-19(27)18-17(24)13-6-8-15(26-20(13)28-18)10-1-3-11(22)4-2-10/h1-9H,24H2,(H,25,27)
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n/an/a>2.00E+5n/an/an/an/an/an/a



University of Maryland, Baltimore; The Board of Regents of the University of Texas System; Sanford-Burnham Medical Research Institute

US Patent


Assay Description
A general phosphate detection assay method using Malachite Green reagent was adapted to measure the activity of NaMN adenylyltransferaseA14. Briefly,...


US Patent US8785499 (2014)

More data for this
Ligand-Target Pair
Nicotinate-nucleotide adenylyltransferase (NadD)


(Escherichia coli)
BDBM81361
PNG
(NadD inhibitor 3_23 | US8785499, 3_23)
Show SMILES Nc1c(sc2nc(ccc12)-c1ccc(F)cc1)C(=O)Nc1ccc(F)cc1Cl
Show InChI InChI=1S/C20H12ClF2N3OS/c21-14-9-12(23)5-7-16(14)25-19(27)18-17(24)13-6-8-15(26-20(13)28-18)10-1-3-11(22)4-2-10/h1-9H,24H2,(H,25,27)
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n/an/a>2.00E+5n/an/an/an/an/an/a



Burnham Institute for Medical Research



Assay Description
The enzymatic assay was masured at fixed NaMN and ATP concentration (equal to two-fold km values)with various concentration of inhibitory compounds.


Chem Biol 16: 849-61 (2009)

More data for this
Ligand-Target Pair