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PubMed code 16337789

Compile data set for download or QSAR
Found 40 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
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178912
PNG
(9-cyclopropyl-6-fluoro-7-(pyridin-3-yl)isothiazolo...)
Show SMILES Fc1cc2c(cc1-c1cccnc1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C18H12FN3O2S/c19-13-6-12-14(7-11(13)9-2-1-5-20-8-9)22(10-3-4-10)18-15(16(12)23)17(24)21-25-18/h1-2,5-8,10H,3-4H2,(H,21,24)
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n/an/a 500n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178913
PNG
(7-(6-(aminomethyl)pyridin-3-yl)-9-cyclopropyl-6-fl...)
Show SMILES NCc1ccc(cn1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C19H15FN4O2S/c20-14-5-13-15(6-12(14)9-1-2-10(7-21)22-8-9)24(11-3-4-11)19-16(17(13)25)18(26)23-27-19/h1-2,5-6,8,11H,3-4,7,21H2,(H,23,26)
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n/an/a 700n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50131428
PNG
(1-Cyclopropyl-6-fluoro-8-methoxy-7-(1S,7aS)-octahy...)
Show SMILES COc1c(N2CC3CCCNC3C2)c(F)cc2C(=O)C(CN(C3CC3)c12)C(O)=O
Show InChI InChI=1S/C21H26FN3O4/c1-29-20-17-13(19(26)14(21(27)28)9-25(17)12-4-5-12)7-15(22)18(20)24-8-11-3-2-6-23-16(11)10-24/h7,11-12,14,16,23H,2-6,8-10H2,1H3,(H,27,28)
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n/an/a 800n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM21690
PNG
(1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,...)
Show SMILES OC(=O)c1cn(C2CC2)c2cc(N3CCNCC3)c(F)cc2c1=O
Show InChI InChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178914
PNG
(9-cyclopropyl-6-fluoro-7-(5-(pyrrolidin-2-yl)pyrid...)
Show SMILES Fc1cc2c(cc1-c1cncc(c1)C1CCCN1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C22H19FN4O2S/c23-16-7-15-18(27(13-3-4-13)22-19(20(15)28)21(29)26-30-22)8-14(16)11-6-12(10-24-9-11)17-2-1-5-25-17/h6-10,13,17,25H,1-5H2,(H,26,29)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178892
PNG
(9-cyclopropyl-6-fluoro-7-(pyridin-4-yl)isothiazolo...)
Show SMILES Fc1cc2c(cc1-c1ccncc1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C18H12FN3O2S/c19-13-7-12-14(8-11(13)9-3-5-20-6-4-9)22(10-1-2-10)18-15(16(12)23)17(24)21-25-18/h3-8,10H,1-2H2,(H,21,24)
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n/an/a 2.20E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178905
PNG
(9-cyclopropyl-6-fluoro-7-(2-fluoropyridin-3-yl)iso...)
Show SMILES Fc1cc2c(cc1-c1cccnc1F)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C18H11F2N3O2S/c19-12-6-11-13(7-10(12)9-2-1-5-21-16(9)20)23(8-3-4-8)18-14(15(11)24)17(25)22-26-18/h1-2,5-8H,3-4H2,(H,22,25)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178894
PNG
(9-cyclopropyl-6-fluoro-7-(quinolin-6-yl)isothiazol...)
Show SMILES Fc1cc2c(cc1-c1ccc3ncccc3c1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C22H14FN3O2S/c23-16-9-15-18(10-14(16)11-3-6-17-12(8-11)2-1-7-24-17)26(13-4-5-13)22-19(20(15)27)21(28)25-29-22/h1-3,6-10,13H,4-5H2,(H,25,28)
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n/an/a 3.20E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178904
PNG
(9-cyclopropyl-6-fluoro-7-(1H-indol-2-yl)isothiazol...)
Show SMILES Fc1cc2c(cc1-c1cc3ccccc3[nH]1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C21H14FN3O2S/c22-14-8-13-17(9-12(14)16-7-10-3-1-2-4-15(10)23-16)25(11-5-6-11)21-18(19(13)26)20(27)24-28-21/h1-4,7-9,11,23H,5-6H2,(H,24,27)
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n/an/a 3.30E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178897
PNG
(9-cyclopropyl-6-fluoro-7-(2-methoxypyrimidin-5-yl)...)
Show SMILES COc1ncc(cn1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C18H13FN4O3S/c1-26-18-20-6-8(7-21-18)10-5-13-11(4-12(10)19)15(24)14-16(25)22-27-17(14)23(13)9-2-3-9/h4-7,9H,2-3H2,1H3,(H,22,25)
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n/an/a 3.30E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178884
PNG
(9-cyclopropyl-6-fluoro-7-(pyrimidin-5-yl)isothiazo...)
Show SMILES Fc1cc2c(cc1-c1cncnc1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C17H11FN4O2S/c18-12-3-11-13(4-10(12)8-5-19-7-20-6-8)22(9-1-2-9)17-14(15(11)23)16(24)21-25-17/h3-7,9H,1-2H2,(H,21,24)
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n/an/a 3.30E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178882
PNG
(9-cyclopropyl-6-fluoro-7-(2-methylpyridin-3-yl)iso...)
Show SMILES Cc1ncccc1-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C19H14FN3O2S/c1-9-11(3-2-6-21-9)12-8-15-13(7-14(12)20)17(24)16-18(25)22-26-19(16)23(15)10-4-5-10/h2-3,6-8,10H,4-5H2,1H3,(H,22,25)
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n/an/a 3.50E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178878
PNG
(9-cyclopropyl-6-fluoro-7-(isoquinolin-6-yl)isothia...)
Show SMILES Fc1cc2c(cc1-c1ccc3cnccc3c1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C22H14FN3O2S/c23-17-8-16-18(9-15(17)12-1-2-13-10-24-6-5-11(13)7-12)26(14-3-4-14)22-19(20(16)27)21(28)25-29-22/h1-2,5-10,14H,3-4H2,(H,25,28)
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n/an/a 3.60E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178909
PNG
(9-cyclopropyl-6-fluoro-7-(1-methyl-1H-indol-5-yl)i...)
Show SMILES Cn1ccc2cc(ccc12)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C22H16FN3O2S/c1-25-7-6-12-8-11(2-5-17(12)25)14-10-18-15(9-16(14)23)20(27)19-21(28)24-29-22(19)26(18)13-3-4-13/h2,5-10,13H,3-4H2,1H3,(H,24,28)
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n/an/a 3.60E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178907
PNG
(9-cyclopropyl-6-fluoro-7-(2-(hydroxymethyl)pyridin...)
Show SMILES OCc1cc(ccn1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C19H14FN3O3S/c20-14-6-13-15(7-12(14)9-3-4-21-10(5-9)8-24)23(11-1-2-11)19-16(17(13)25)18(26)22-27-19/h3-7,11,24H,1-2,8H2,(H,22,26)
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n/an/a 4.80E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178910
PNG
(9-cyclopropyl-6-fluoro-7-(5-(piperidin-2-yl)pyridi...)
Show SMILES Fc1cc2c(cc1-c1cncc(c1)C1CCCCN1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C23H21FN4O2S/c24-17-8-16-19(28(14-4-5-14)23-20(21(16)29)22(30)27-31-23)9-15(17)12-7-13(11-25-10-12)18-3-1-2-6-26-18/h7-11,14,18,26H,1-6H2,(H,27,30)
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n/an/a 5.00E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178915
PNG
(9-cyclopropyl-6-fluoro-7-phenylisothiazolo[5,4-b]q...)
Show SMILES Fc1cc2c(cc1-c1ccccc1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C19H13FN2O2S/c20-14-8-13-15(9-12(14)10-4-2-1-3-5-10)22(11-6-7-11)19-16(17(13)23)18(24)21-25-19/h1-5,8-9,11H,6-7H2,(H,21,24)
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n/an/a 6.30E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178888
PNG
(9-cyclopropyl-7-(2,6-dimethylpyridin-3-yl)-6-fluor...)
Show SMILES Cc1ccc(c(C)n1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C20H16FN3O2S/c1-9-3-6-12(10(2)22-9)13-8-16-14(7-15(13)21)18(25)17-19(26)23-27-20(17)24(16)11-4-5-11/h3,6-8,11H,4-5H2,1-2H3,(H,23,26)
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n/an/a 8.00E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178902
PNG
(9-cyclopropyl-6-fluoro-7-(6-methylpyridin-3-yl)iso...)
Show SMILES Cc1ccc(cn1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C19H14FN3O2S/c1-9-2-3-10(8-21-9)12-7-15-13(6-14(12)20)17(24)16-18(25)22-26-19(16)23(15)11-4-5-11/h2-3,6-8,11H,4-5H2,1H3,(H,22,25)
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n/an/a 8.50E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178886
PNG
(9-cyclopropyl-6-fluoro-7-(1H-pyrrol-2-yl)isothiazo...)
Show SMILES Fc1cc2c(cc1-c1ccc[nH]1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C17H12FN3O2S/c18-11-6-10-13(7-9(11)12-2-1-5-19-12)21(8-3-4-8)17-14(15(10)22)16(23)20-24-17/h1-2,5-8,19H,3-4H2,(H,20,23)
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n/an/a 9.90E+3n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178896
PNG
(9-cyclopropyl-6-fluoro-7-(4-methoxypyridin-3-yl)is...)
Show SMILES COc1ccncc1-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C19H14FN3O3S/c1-26-15-4-5-21-8-12(15)10-7-14-11(6-13(10)20)17(24)16-18(25)22-27-19(16)23(14)9-2-3-9/h4-9H,2-3H2,1H3,(H,22,25)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178900
PNG
(9-cyclopropyl-6-fluoro-7-(6-fluoropyridin-3-yl)iso...)
Show SMILES Fc1ccc(cn1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C18H11F2N3O2S/c19-12-5-11-13(6-10(12)8-1-4-14(20)21-7-8)23(9-2-3-9)18-15(16(11)24)17(25)22-26-18/h1,4-7,9H,2-3H2,(H,22,25)
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n/an/a 1.20E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178908
PNG
(9-cyclopropyl-6-fluoro-7-(5-methylpyridin-2-yl)iso...)
Show SMILES Cc1ccc(nc1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C19H14FN3O2S/c1-9-2-5-14(21-8-9)11-7-15-12(6-13(11)20)17(24)16-18(25)22-26-19(16)23(15)10-3-4-10/h2,5-8,10H,3-4H2,1H3,(H,22,25)
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n/an/a 1.40E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178881
PNG
(9-cyclopropyl-7-(2,6-dimethoxypyridin-3-yl)-6-fluo...)
Show SMILES COc1ccc(c(OC)n1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C20H16FN3O4S/c1-27-15-6-5-10(19(22-15)28-2)11-8-14-12(7-13(11)21)17(25)16-18(26)23-29-20(16)24(14)9-3-4-9/h5-9H,3-4H2,1-2H3,(H,23,26)
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n/an/a 1.60E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178899
PNG
(9-cyclopropyl-6-fluoro-7-(4-methylpyridin-2-yl)iso...)
Show SMILES Cc1ccnc(c1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C19H14FN3O2S/c1-9-4-5-21-14(6-9)11-8-15-12(7-13(11)20)17(24)16-18(25)22-26-19(16)23(15)10-2-3-10/h4-8,10H,2-3H2,1H3,(H,22,25)
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n/an/a 1.60E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178890
PNG
(7-(6-(1H-pyrrol-1-yl)pyridin-3-yl)-9-cyclopropyl-6...)
Show SMILES Fc1cc2c(cc1-c1ccc(nc1)-n1cccc1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C22H15FN4O2S/c23-16-9-15-17(27(13-4-5-13)22-19(20(15)28)21(29)25-30-22)10-14(16)12-3-6-18(24-11-12)26-7-1-2-8-26/h1-3,6-11,13H,4-5H2,(H,25,29)
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n/an/a 1.80E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178880
PNG
(9-cyclopropyl-6-fluoro-7-(2-fluoropyridin-4-yl)iso...)
Show SMILES Fc1cc(ccn1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C18H11F2N3O2S/c19-12-6-11-13(7-10(12)8-3-4-21-14(20)5-8)23(9-1-2-9)18-15(16(11)24)17(25)22-26-18/h3-7,9H,1-2H2,(H,22,25)
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n/an/a 1.90E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178891
PNG
(9-cyclopropyl-6-fluoro-7-(5-methoxypyridin-3-yl)is...)
Show SMILES COc1cncc(c1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C19H14FN3O3S/c1-26-11-4-9(7-21-8-11)12-6-15-13(5-14(12)20)17(24)16-18(25)22-27-19(16)23(15)10-2-3-10/h4-8,10H,2-3H2,1H3,(H,22,25)
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n/an/a 2.10E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178903
PNG
(9-cyclopropyl-6-fluoro-7-(isoquinolin-5-yl)isothia...)
Show SMILES Fc1cc2c(cc1-c1cccc3cnccc13)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C22H14FN3O2S/c23-17-8-16-18(9-15(17)14-3-1-2-11-10-24-7-6-13(11)14)26(12-4-5-12)22-19(20(16)27)21(28)25-29-22/h1-3,6-10,12H,4-5H2,(H,25,28)
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n/an/a 2.30E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178898
PNG
(9-cyclopropyl-6-fluoro-7-(6-methoxypyridin-3-yl)is...)
Show SMILES COc1ccc(cn1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C19H14FN3O3S/c1-26-15-5-2-9(8-21-15)11-7-14-12(6-13(11)20)17(24)16-18(25)22-27-19(16)23(14)10-3-4-10/h2,5-8,10H,3-4H2,1H3,(H,22,25)
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n/an/a 2.60E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178906
PNG
(9-cyclopropyl-6-fluoro-7-(2-methylpyridin-4-yl)iso...)
Show SMILES Cc1cc(ccn1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C19H14FN3O2S/c1-9-6-10(4-5-21-9)12-8-15-13(7-14(12)20)17(24)16-18(25)22-26-19(16)23(15)11-2-3-11/h4-8,11H,2-3H2,1H3,(H,22,25)
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n/an/a 2.60E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178883
PNG
(9-cyclopropyl-6-fluoro-7-(quinazolin-7-yl)isothiaz...)
Show SMILES Fc1cc2c(cc1-c1ccc3cncnc3c1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C21H13FN4O2S/c22-15-6-14-17(7-13(15)10-1-2-11-8-23-9-24-16(11)5-10)26(12-3-4-12)21-18(19(14)27)20(28)25-29-21/h1-2,5-9,12H,3-4H2,(H,25,28)
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n/an/a 2.90E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178885
PNG
(9-cyclopropyl-6-fluoro-7-(quinolin-5-yl)isothiazol...)
Show SMILES Fc1cc2c(cc1-c1cccc3ncccc13)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C22H14FN3O2S/c23-16-9-15-18(10-14(16)12-3-1-5-17-13(12)4-2-8-24-17)26(11-6-7-11)22-19(20(15)27)21(28)25-29-22/h1-5,8-11H,6-7H2,(H,25,28)
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n/an/a 3.30E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178893
PNG
(9-cyclopropyl-6-fluoro-7-(isoquinolin-4-yl)isothia...)
Show SMILES Fc1cc2c(cc1-c1cncc3ccccc13)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C22H14FN3O2S/c23-17-7-15-18(8-14(17)16-10-24-9-11-3-1-2-4-13(11)16)26(12-5-6-12)22-19(20(15)27)21(28)25-29-22/h1-4,7-10,12H,5-6H2,(H,25,28)
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n/an/a>3.80E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178895
PNG
(9-cyclopropyl-6-fluoro-7-(quinolin-8-yl)isothiazol...)
Show SMILES Fc1cc2c(cc1-c1cccc3cccnc13)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C22H14FN3O2S/c23-16-9-15-17(10-14(16)13-5-1-3-11-4-2-8-24-19(11)13)26(12-6-7-12)22-18(20(15)27)21(28)25-29-22/h1-5,8-10,12H,6-7H2,(H,25,28)
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n/an/a>4.00E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178901
PNG
(9-cyclopropyl-6-fluoro-7-(1H-indol-5-yl)isothiazol...)
Show SMILES Fc1cc2c(cc1-c1ccc3[nH]ccc3c1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C21H14FN3O2S/c22-15-8-14-17(9-13(15)10-1-4-16-11(7-10)5-6-23-16)25(12-2-3-12)21-18(19(14)26)20(27)24-28-21/h1,4-9,12,23H,2-3H2,(H,24,27)
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n/an/a>4.00E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178889
PNG
(9-cyclopropyl-7-(2,4-dimethoxypyrimidin-5-yl)-6-fl...)
Show SMILES COc1ncc(c(OC)n1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C19H15FN4O4S/c1-27-17-11(7-21-19(22-17)28-2)9-6-13-10(5-12(9)20)15(25)14-16(26)23-29-18(14)24(13)8-3-4-8/h5-8H,3-4H2,1-2H3,(H,23,26)
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n/an/a 4.20E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178879
PNG
(9-cyclopropyl-7-(2,6-dimethylpyridin-4-yl)-6-fluor...)
Show SMILES Cc1cc(cc(C)n1)-c1cc2n(C3CC3)c3s[nH]c(=O)c3c(=O)c2cc1F
Show InChI InChI=1S/C20H16FN3O2S/c1-9-5-11(6-10(2)22-9)13-8-16-14(7-15(13)21)18(25)17-19(26)23-27-20(17)24(16)12-3-4-12/h5-8,12H,3-4H2,1-2H3,(H,23,26)
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n/an/a 4.80E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178887
PNG
(9-cyclopropyl-6-fluoro-7-(quinolin-3-yl)isothiazol...)
Show SMILES Fc1cc2c(cc1-c1cnc3ccccc3c1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C22H14FN3O2S/c23-16-8-15-18(9-14(16)12-7-11-3-1-2-4-17(11)24-10-12)26(13-5-6-13)22-19(20(15)27)21(28)25-29-22/h1-4,7-10,13H,5-6H2,(H,25,28)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 5.00E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
DNA topoisomerase 4 subunit A


(Staphylococcus aureus)		BDBM50178911
PNG
(9-cyclopropyl-6-fluoro-7-(pyrazin-2-yl)isothiazolo...)
Show SMILES Fc1cc2c(cc1-c1cnccn1)n(C1CC1)c1s[nH]c(=O)c1c2=O
Show InChI InChI=1S/C17H11FN4O2S/c18-11-5-10-13(6-9(11)12-7-19-3-4-20-12)22(8-1-2-8)17-14(15(10)23)16(24)21-25-17/h3-8H,1-2H2,(H,21,24)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 6.40E+4n/an/an/an/an/an/a



Achillion Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Staphylococcus aureus ATCC 29213 wild type Topo 4

Bioorg Med Chem Lett 16: 1277-81 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.064
BindingDB Entry DOI: 10.7270/Q26D5SKN
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%