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Compile Data Set for Download or QSAR

Found 44 hits of ic50 for UniProtKB: P9WIQ1   
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
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM68226
PNG
(Thiazolidinone core, 10)
Show SMILES Oc1cc(Cl)c(\C=c2/sc3nc4ccccc4n3c2=O)cc1N(=O)=O
Show InChI InChI=1S/C16H8ClN3O4S/c17-9-7-13(21)12(20(23)24)5-8(9)6-14-15(22)19-11-4-2-1-3-10(11)18-16(19)25-14/h1-7,21H/b14-6-
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n/an/a 28 5.30E+3n/an/an/an/an/a



University of Wisconsin-Madison



Assay Description
To access the ability of compounds to inhibit the catalytic activity of UGM, an HPLC assay was employed. Inhibition constants were determined by mon...

Chem Biol 13: 825-37 (2006)


Article DOI: 10.1016/j.chembiol.2006.06.007
BindingDB Entry DOI: 10.7270/Q2DV1HB1
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM68247
PNG
(Fluorescent Probe 1)
Show SMILES OC1C(O)C(OC1COP([O-])(=O)OP([O-])(=O)OCCCCCCNC(=S)Nc1ccc(c(c1)C([O-])=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12)n1ccc(=O)[nH]c1=O |(22.94,6.54,;24.09,7.57,;25.59,7.25,;26.22,5.84,;26.36,8.58,;25.33,9.73,;23.93,9.1,;22.59,9.87,;21.26,9.1,;19.93,9.87,;19.16,8.54,;20.7,11.21,;18.59,10.64,;17.26,9.87,;16.49,11.21,;18.03,8.54,;15.92,9.1,;14.59,9.87,;13.26,9.1,;11.92,9.87,;10.59,9.1,;9.26,9.87,;7.92,9.1,;6.59,9.87,;5.26,9.1,;5.26,7.56,;3.92,9.87,;2.59,9.1,;1.25,9.87,;-.08,9.1,;-.08,7.56,;1.25,6.79,;2.59,7.56,;1.25,5.25,;.63,3.85,;2.59,4.48,;-1.41,6.79,;-2.75,7.56,;-2.75,9.1,;-4.08,9.87,;-5.41,9.1,;-6.75,9.87,;-5.41,7.56,;-4.08,6.79,;-4.08,5.25,;-2.75,4.48,;-2.75,2.94,;-1.41,2.17,;-1.41,.63,;-.08,2.94,;-.08,4.48,;-1.41,5.25,;27.9,8.74,;28.8,7.5,;30.33,7.66,;30.96,9.07,;32.49,9.23,;30.05,10.31,;28.52,10.15,;27.62,11.4,)|
Show InChI InChI=1S/C36H38N4O17P2S/c41-20-6-9-23-26(16-20)55-27-17-21(42)7-10-24(27)30(23)22-8-5-19(15-25(22)34(46)47)38-35(60)37-12-3-1-2-4-14-53-58(49,50)57-59(51,52)54-18-28-31(44)32(45)33(56-28)40-13-11-29(43)39-36(40)48/h5-11,13,15-17,28,31-33,41,44-45H,1-4,12,14,18H2,(H,46,47)(H,49,50)(H,51,52)(H2,37,38,60)(H,39,43,48)/p-3
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n/an/a 5.70E+3 160n/an/an/an/an/a



University of Wisconsin-Madison



Assay Description
To access the ability of compounds to inhibit the catalytic activity of UGM, an HPLC assay was employed. Inhibition constants were determined by mon...

Chem Biol 13: 825-37 (2006)


Article DOI: 10.1016/j.chembiol.2006.06.007
BindingDB Entry DOI: 10.7270/Q2DV1HB1
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50202277
PNG
((S)-2-(5-(4-bromobenzylidene)-4-oxo-2-thioxothiazo...)
Show SMILES OC(=O)[C@H](Cc1ccccc1)N1C(=S)S\C(=C/c2ccc(Br)cc2)C1=O
Show InChI InChI=1S/C19H14BrNO3S2/c20-14-8-6-13(7-9-14)11-16-17(22)21(19(25)26-16)15(18(23)24)10-12-4-2-1-3-5-12/h1-9,11,15H,10H2,(H,23,24)/b16-11-/t15-/m0/s1
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n/an/a 3.50E+4 9.30E+3n/an/an/an/an/a



University of Wisconsin-Madison



Assay Description
To access the ability of compounds to inhibit the catalytic activity of UGM, an HPLC assay was employed. Inhibition constants were determined by mon...

Chem Biol 13: 825-37 (2006)


Article DOI: 10.1016/j.chembiol.2006.06.007
BindingDB Entry DOI: 10.7270/Q2DV1HB1
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475087
PNG
(CHEMBL363713)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1cccc(Br)c1
Show InChI InChI=1S/C11H7BrN2O4/c12-7-2-1-3-8(6-7)13-11(15)9-4-5-10(18-9)14(16)17/h1-6H,(H,13,15)
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n/an/a 3.53E+4n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM68228
PNG
(Thiazolidinone core, 22)
Show SMILES OC(=O)C(Cc1ccccc1)N1C(=S)S\C(=C/c2cccc(I)c2)C1=O
Show InChI InChI=1S/C19H14INO3S2/c20-14-8-4-7-13(9-14)11-16-17(22)21(19(25)26-16)15(18(23)24)10-12-5-2-1-3-6-12/h1-9,11,15H,10H2,(H,23,24)/b16-11-
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n/an/a 4.10E+4 6.00E+3n/an/an/an/an/a



University of Wisconsin-Madison



Assay Description
To access the ability of compounds to inhibit the catalytic activity of UGM, an HPLC assay was employed. Inhibition constants were determined by mon...

Chem Biol 13: 825-37 (2006)


Article DOI: 10.1016/j.chembiol.2006.06.007
BindingDB Entry DOI: 10.7270/Q2DV1HB1
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM68225
PNG
(Thiazolidinone core, 9)
Show SMILES Clc1ccc(cc1Cl)N1NC(=O)C(=Cc2ccc(Cl)c(c2)N(=O)=O)C1=O |w:13.14|
Show InChI InChI=1S/C16H8Cl3N3O4/c17-11-4-2-9(7-13(11)19)21-16(24)10(15(23)20-21)5-8-1-3-12(18)14(6-8)22(25)26/h1-7H,(H,20,23)
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n/an/a 4.10E+4 4.90E+3n/an/an/an/an/a



University of Wisconsin-Madison



Assay Description
To access the ability of compounds to inhibit the catalytic activity of UGM, an HPLC assay was employed. Inhibition constants were determined by mon...

Chem Biol 13: 825-37 (2006)


Article DOI: 10.1016/j.chembiol.2006.06.007
BindingDB Entry DOI: 10.7270/Q2DV1HB1
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM68227
PNG
(Thiazolidinone core, 21)
Show SMILES OC(=O)C(Cc1ccccc1)N1C(=S)S\C(=C/c2cccc(Cl)c2)C1=O
Show InChI InChI=1S/C19H14ClNO3S2/c20-14-8-4-7-13(9-14)11-16-17(22)21(19(25)26-16)15(18(23)24)10-12-5-2-1-3-6-12/h1-9,11,15H,10H2,(H,23,24)/b16-11-
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n/an/a 4.90E+4 1.60E+4n/an/an/an/an/a



University of Wisconsin-Madison



Assay Description
To access the ability of compounds to inhibit the catalytic activity of UGM, an HPLC assay was employed. Inhibition constants were determined by mon...

Chem Biol 13: 825-37 (2006)


Article DOI: 10.1016/j.chembiol.2006.06.007
BindingDB Entry DOI: 10.7270/Q2DV1HB1
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475080
PNG
(CHEMBL188990)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)NCc1ccccc1Cl
Show InChI InChI=1S/C12H9ClN2O4/c13-9-4-2-1-3-8(9)7-14-12(16)10-5-6-11(19-10)15(17)18/h1-6H,7H2,(H,14,16)
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n/an/a 5.34E+4n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475083
PNG
(CHEMBL184155)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1cccc(Cl)c1
Show InChI InChI=1S/C11H7ClN2O4/c12-7-2-1-3-8(6-7)13-11(15)9-4-5-10(18-9)14(16)17/h1-6H,(H,13,15)
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n/an/a 5.62E+4n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475084
PNG
(CHEMBL189140)
Show SMILES COc1ccc(CCNC(=O)c2ccc(o2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C14H14N2O5/c1-20-11-4-2-10(3-5-11)8-9-15-14(17)12-6-7-13(21-12)16(18)19/h2-7H,8-9H2,1H3,(H,15,17)
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n/an/a 5.85E+4n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475085
PNG
(CHEMBL188537)
Show SMILES COc1cccc(NC(=O)c2ccc(o2)S(=O)(=O)c2ccccc2)c1
Show InChI InChI=1S/C18H15NO5S/c1-23-14-7-5-6-13(12-14)19-18(20)16-10-11-17(24-16)25(21,22)15-8-3-2-4-9-15/h2-12H,1H3,(H,19,20)
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n/an/a 6.43E+4n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM68222
PNG
(Thiazolidinone core, 6)
Show SMILES OC(=O)C(Cc1ccccc1)N1C(=S)S\C(=C\c2cccc(Br)c2)C1=O
Show InChI InChI=1S/C19H14BrNO3S2/c20-14-8-4-7-13(9-14)11-16-17(22)21(19(25)26-16)15(18(23)24)10-12-5-2-1-3-6-12/h1-9,11,15H,10H2,(H,23,24)/b16-11+
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n/an/a 6.50E+4 1.20E+4n/an/an/an/an/a



University of Wisconsin-Madison



Assay Description
To access the ability of compounds to inhibit the catalytic activity of UGM, an HPLC assay was employed. Inhibition constants were determined by mon...

Chem Biol 13: 825-37 (2006)


Article DOI: 10.1016/j.chembiol.2006.06.007
BindingDB Entry DOI: 10.7270/Q2DV1HB1
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475094
PNG
(CHEMBL189241)
Show SMILES COc1ccc(CNC(=O)c2ccc(o2)[N+]([O-])=O)cc1OC
Show InChI InChI=1S/C14H14N2O6/c1-20-10-4-3-9(7-12(10)21-2)8-15-14(17)11-5-6-13(22-11)16(18)19/h3-7H,8H2,1-2H3,(H,15,17)
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n/an/a 7.50E+4n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475097
PNG
(CHEMBL188250)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C18H14N2O5/c21-18(16-9-10-17(25-16)20(22)23)19-14-7-4-8-15(11-14)24-12-13-5-2-1-3-6-13/h1-11H,12H2,(H,19,21)
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n/an/a 8.27E+4n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475079
PNG
(CHEMBL363957)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C11H8N2O4/c14-11(12-8-4-2-1-3-5-8)9-6-7-10(17-9)13(15)16/h1-7H,(H,12,14)
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n/an/a 9.47E+4n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM68229
PNG
(Thiazolidinone core, 30)
Show SMILES OC(=O)C(Cc1ccccc1)N1C(=S)S\C(C1=O)=C1/C(=O)Nc2ccc(cc12)N(=O)=O
Show InChI InChI=1S/C20H13N3O6S2/c24-17-15(12-9-11(23(28)29)6-7-13(12)21-17)16-18(25)22(20(30)31-16)14(19(26)27)8-10-4-2-1-3-5-10/h1-7,9,14H,8H2,(H,21,24)(H,26,27)/b16-15-
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n/an/a>1.00E+5 1.00E+4n/an/an/an/an/a



University of Wisconsin-Madison



Assay Description
To access the ability of compounds to inhibit the catalytic activity of UGM, an HPLC assay was employed. Inhibition constants were determined by mon...

Chem Biol 13: 825-37 (2006)


Article DOI: 10.1016/j.chembiol.2006.06.007
BindingDB Entry DOI: 10.7270/Q2DV1HB1
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475071
PNG
(CHEMBL364847)
Show SMILES COc1ccc(CNC(=O)c2ccc(o2)[N+]([O-])=O)c(OC)c1
Show InChI InChI=1S/C14H14N2O6/c1-20-10-4-3-9(12(7-10)21-2)8-15-14(17)11-5-6-13(22-11)16(18)19/h3-7H,8H2,1-2H3,(H,15,17)
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n/an/a 1.11E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475081
PNG
(CHEMBL362335)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1cccc(F)c1
Show InChI InChI=1S/C11H7FN2O4/c12-7-2-1-3-8(6-7)13-11(15)9-4-5-10(18-9)14(16)17/h1-6H,(H,13,15)
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n/an/a 1.11E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475098
PNG
(CHEMBL366131)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)NC1CCCc2ccccc12
Show InChI InChI=1S/C15H14N2O4/c18-15(13-8-9-14(21-13)17(19)20)16-12-7-3-5-10-4-1-2-6-11(10)12/h1-2,4,6,8-9,12H,3,5,7H2,(H,16,18)
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University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475091
PNG
(CHEMBL363761)
Show SMILES C[C@H](NC(=O)c1ccc(o1)[N+]([O-])=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O4/c1-9(10-5-3-2-4-6-10)14-13(16)11-7-8-12(19-11)15(17)18/h2-9H,1H3,(H,14,16)/t9-/m0/s1
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n/an/a 1.46E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475089
PNG
(CHEMBL364555)
Show SMILES C[C@@H](NC(=O)c1ccc(o1)[N+]([O-])=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O4/c1-9(10-5-3-2-4-6-10)14-13(16)11-7-8-12(19-11)15(17)18/h2-9H,1H3,(H,14,16)/t9-/m1/s1
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n/an/a 1.49E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475074
PNG
(CHEMBL365901)
Show SMILES COc1cccc(NC(=O)c2ccc(o2)[N+]([O-])=O)c1
Show InChI InChI=1S/C12H10N2O5/c1-18-9-4-2-3-8(7-9)13-12(15)10-5-6-11(19-10)14(16)17/h2-7H,1H3,(H,13,15)
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n/an/a 1.60E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM65582
PNG
(5-Nitro-furan-2-carboxylic acid (4-methoxy-phenyl)...)
Show SMILES COc1ccc(NC(=O)c2ccc(o2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C12H10N2O5/c1-18-9-4-2-8(3-5-9)13-12(15)10-6-7-11(19-10)14(16)17/h2-7H,1H3,(H,13,15)
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n/an/a 1.60E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475082
PNG
(CHEMBL185935)
Show SMILES COc1ccc(CCNC(=O)c2ccc(o2)[N+]([O-])=O)cc1OC
Show InChI InChI=1S/C15H16N2O6/c1-21-11-4-3-10(9-13(11)22-2)7-8-16-15(18)12-5-6-14(23-12)17(19)20/h3-6,9H,7-8H2,1-2H3,(H,16,18)
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n/an/a 1.65E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM53451
PNG
(MLS001163735 | N-(1-adamantyl)-5-nitro-2-furamide ...)
Show SMILES [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)NC(=O)c1ccc(o1)[N+]([O-])=O |TLB:8:6:12:1.11.2,5:3:11:6.9.8,THB:5:6:11:3.12.2|
Show InChI InChI=1S/C15H18N2O4/c18-14(12-1-2-13(21-12)17(19)20)16-15-6-9-3-10(7-15)5-11(4-9)8-15/h1-2,9-11H,3-8H2,(H,16,18)
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n/an/a 1.68E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475096
PNG
(CHEMBL363121)
Show SMILES COc1cc(CNC(=O)c2ccc(o2)[N+]([O-])=O)cc(OC)c1OC
Show InChI InChI=1S/C15H16N2O7/c1-21-11-6-9(7-12(22-2)14(11)23-3)8-16-15(18)10-4-5-13(24-10)17(19)20/h4-7H,8H2,1-3H3,(H,16,18)
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n/an/a 1.84E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475095
PNG
(CHEMBL364195)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccncc1
Show InChI InChI=1S/C10H7N3O4/c14-10(12-7-3-5-11-6-4-7)8-1-2-9(17-8)13(15)16/h1-6H,(H,11,12,14)
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n/an/a 1.84E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM96269
PNG
(5-Nitro-furan-2-carboxylic acid pyridin-3-ylamide ...)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1cccnc1
Show InChI InChI=1S/C10H7N3O4/c14-10(12-7-2-1-5-11-6-7)8-3-4-9(17-8)13(15)16/h1-6H,(H,12,14)
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n/an/a 2.05E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475093
PNG
(CHEMBL188467)
Show SMILES COc1cccc2sc(NC(=O)c3ccc(o3)[N+]([O-])=O)nc12
Show InChI InChI=1S/C13H9N3O5S/c1-20-7-3-2-4-9-11(7)14-13(22-9)15-12(17)8-5-6-10(21-8)16(18)19/h2-6H,1H3,(H,14,15,17)
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n/an/a 2.09E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475101
PNG
(CHEMBL188734)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccccn1
Show InChI InChI=1S/C10H7N3O4/c14-10(12-8-3-1-2-6-11-8)7-4-5-9(17-7)13(15)16/h1-6H,(H,11,12,14)
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n/an/a 2.27E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM49921
PNG
(MLS000708257 | N-(2-furanylmethyl)-5-nitro-2-furan...)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)NCc1ccco1
Show InChI InChI=1S/C10H8N2O5/c13-10(11-6-7-2-1-5-16-7)8-3-4-9(17-8)12(14)15/h1-5H,6H2,(H,11,13)
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n/an/a 2.45E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475092
PNG
(CHEMBL184206)
Show SMILES CN(C(=O)c1ccc(o1)[N+]([O-])=O)c1ccccc1
Show InChI InChI=1S/C12H10N2O4/c1-13(9-5-3-2-4-6-9)12(15)10-7-8-11(18-10)14(16)17/h2-8H,1H3
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n/an/a 2.59E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475076
PNG
(CHEMBL186421)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)NC1CCc2ccccc12
Show InChI InChI=1S/C14H12N2O4/c17-14(12-7-8-13(20-12)16(18)19)15-11-6-5-9-3-1-2-4-10(9)11/h1-4,7-8,11H,5-6H2,(H,15,17)
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n/an/a 2.64E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475100
PNG
(CHEMBL186248)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C11H14N2O4/c14-11(12-8-4-2-1-3-5-8)9-6-7-10(17-9)13(15)16/h6-8H,1-5H2,(H,12,14)
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n/an/a 2.81E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475078
PNG
(CHEMBL366113)
Show SMILES Oc1cccc(NC(=O)c2ccc(o2)[N+]([O-])=O)c1
Show InChI InChI=1S/C11H8N2O5/c14-8-3-1-2-7(6-8)12-11(15)9-4-5-10(18-9)13(16)17/h1-6,14H,(H,12,15)
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n/an/a 3.14E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475090
PNG
(CHEMBL434530)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)NCCc1ccccc1
Show InChI InChI=1S/C13H12N2O4/c16-13(11-6-7-12(19-11)15(17)18)14-9-8-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,14,16)
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n/an/a 3.15E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475099
PNG
(CHEMBL426620)
Show SMILES COc1ccccc1CNC(=O)c1ccc(o1)[N+]([O-])=O
Show InChI InChI=1S/C13H12N2O5/c1-19-10-5-3-2-4-9(10)8-14-13(16)11-6-7-12(20-11)15(17)18/h2-7H,8H2,1H3,(H,14,16)
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n/an/a 3.58E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475086
PNG
(CHEMBL363736)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1ccc(cc1)C#N
Show InChI InChI=1S/C12H7N3O4/c13-7-8-1-3-9(4-2-8)14-12(16)10-5-6-11(19-10)15(17)18/h1-6H,(H,14,16)
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n/an/a 3.92E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475077
PNG
(CHEMBL363657)
Show SMILES COc1ccc(CNC(=O)c2ccc(o2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C13H12N2O5/c1-19-10-4-2-9(3-5-10)8-14-13(16)11-6-7-12(20-11)15(17)18/h2-7H,8H2,1H3,(H,14,16)
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n/an/a 4.16E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475088
PNG
(CHEMBL186534)
Show SMILES COc1cccc(CNC(=O)c2ccc(o2)[N+]([O-])=O)c1OC
Show InChI InChI=1S/C14H14N2O6/c1-20-10-5-3-4-9(13(10)21-2)8-15-14(17)11-6-7-12(22-11)16(18)19/h3-7H,8H2,1-2H3,(H,15,17)
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n/an/a 4.63E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475073
PNG
(CHEMBL188880)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)NCc1ccccn1
Show InChI InChI=1S/C11H9N3O4/c15-11(9-4-5-10(18-9)14(16)17)13-7-8-3-1-2-6-12-8/h1-6H,7H2,(H,13,15)
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n/an/a 4.81E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475072
PNG
(CHEMBL361712)
Show SMILES COc1ccc(cc1)N(C)C(=O)c1ccc(o1)[N+]([O-])=O
Show InChI InChI=1S/C13H12N2O5/c1-14(9-3-5-10(19-2)6-4-9)13(16)11-7-8-12(20-11)15(17)18/h3-8H,1-2H3
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n/an/a 4.99E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475070
PNG
(CHEMBL365844)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1cnccn1
Show InChI InChI=1S/C9H6N4O4/c14-9(12-7-5-10-3-4-11-7)6-1-2-8(17-6)13(15)16/h1-5H,(H,11,12,14)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.91E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair
UDP-galactopyranose mutase


(Mycobacterium tuberculosis H37Rv)		BDBM50475075
PNG
(CHEMBL186223)
Show SMILES [O-][N+](=O)c1ccc(o1)C(=O)Nc1cc[nH]n1
Show InChI InChI=1S/C8H6N4O4/c13-8(10-6-3-4-9-11-6)5-1-2-7(16-5)12(14)15/h1-4H,(H2,9,10,11,13)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.29E+5n/an/an/an/an/an/a



University of Tennessee Health Science Center

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis UDP-galactose mutase expressed in Escherichia coli UDP-6 [3H]- Galf

J Med Chem 47: 5276-83 (2004)


Article DOI: 10.1021/jm049972y
BindingDB Entry DOI: 10.7270/Q2VH5RMM
More data for this
Ligand-Target Pair