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Found 60 hits from Birla Institute of Technology & Science-Pilani, Hyderabad Campus   
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
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM282
PNG
((3R,4S,5R,6R)-5-hydroxy-6-[(2-hydroxy-3-{[4-hydrox...)
Show SMILES CO[C@@H]1[C@@H](OC(N)=O)[C@@H](O)[C@H](Oc2ccc3c(O)c(NC(=O)c4ccc(O)c(CC=C(C)C)c4)c(=O)oc3c2C)OC1(C)C
Show InChI InChI=1S/C31H36N2O11/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37)/t23-,25+,26-,29-/m1/s1
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n/an/a 30n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM282
PNG
((3R,4S,5R,6R)-5-hydroxy-6-[(2-hydroxy-3-{[4-hydrox...)
Show SMILES CO[C@@H]1[C@@H](OC(N)=O)[C@@H](O)[C@H](Oc2ccc3c(O)c(NC(=O)c4ccc(O)c(CC=C(C)C)c4)c(=O)oc3c2C)OC1(C)C
Show InChI InChI=1S/C31H36N2O11/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37)/t23-,25+,26-,29-/m1/s1
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n/an/a 125n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM50366824
PNG
(Avelox | MOXIFLOXACIN)
Show SMILES COc1c(N2C[C@@H]3CCCN[C@@H]3C2)c(F)cc2c1n(cc(C(O)=O)c2=O)C1CC1
Show InChI InChI=1S/C21H24FN3O4/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/h7,9,11-12,16,23H,2-6,8,10H2,1H3,(H,27,28)/t11-,16+/m0/s1
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n/an/a 810n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166663
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)-5-methy...)
Show SMILES Cc1ccc(o1)C(=O)Nc1ccc(NC(=O)CCC(=O)NN)cc1
Show InChI InChI=1S/C16H18N4O4/c1-10-2-7-13(24-10)16(23)19-12-5-3-11(4-6-12)18-14(21)8-9-15(22)20-17/h2-7H,8-9,17H2,1H3,(H,18,21)(H,19,23)(H,20,22)
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n/an/a 2.79E+3n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166646
PNG
(4-((4-(furan-2-carboxamido)phenyl)amino)-4-oxobuta...)
Show SMILES OC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccco2)cc1
Show InChI InChI=1S/C15H14N2O5/c18-13(7-8-14(19)20)16-10-3-5-11(6-4-10)17-15(21)12-2-1-9-22-12/h1-6,9H,7-8H2,(H,16,18)(H,17,21)(H,19,20)
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n/an/a 3.12E+3n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166663
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)-5-methy...)
Show SMILES Cc1ccc(o1)C(=O)Nc1ccc(NC(=O)CCC(=O)NN)cc1
Show InChI InChI=1S/C16H18N4O4/c1-10-2-7-13(24-10)16(23)19-12-5-3-11(4-6-12)18-14(21)8-9-15(22)20-17/h2-7H,8-9,17H2,1H3,(H,18,21)(H,19,23)(H,20,22)
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n/an/a 5.35E+3n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166651
PNG
(4-((4-(5-nitrothiophene-2-carboxamido)phenyl)amino...)
Show SMILES OC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(s2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H13N3O6S/c19-12(6-8-14(20)21)16-9-1-3-10(4-2-9)17-15(22)11-5-7-13(25-11)18(23)24/h1-5,7H,6,8H2,(H,16,19)(H,17,22)(H,20,21)
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n/an/a 6.12E+3n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166666
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)-5-methy...)
Show SMILES Cc1ccc(s1)C(=O)Nc1ccc(NC(=O)CCC(=O)NN)cc1
Show InChI InChI=1S/C16H18N4O3S/c1-10-2-7-13(24-10)16(23)19-12-5-3-11(4-6-12)18-14(21)8-9-15(22)20-17/h2-7H,8-9,17H2,1H3,(H,18,21)(H,19,23)(H,20,22)
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n/an/a 6.12E+3n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166655
PNG
(4-(4-(5-methylfuran-2-carboxamido)phenylamino)-4-o...)
Show SMILES Cc1ccc(o1)C(=O)Nc1ccc(NC(=O)CCC([O-])=O)cc1
Show InChI InChI=1S/C16H16N2O5/c1-10-2-7-13(23-10)16(22)18-12-5-3-11(4-6-12)17-14(19)8-9-15(20)21/h2-7H,8-9H2,1H3,(H,17,19)(H,18,22)(H,20,21)/p-1
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n/an/a 6.12E+3n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166661
PNG
(4-oxo-4-(4-(tetrahydrofuran-2-carboxamido)phenylam...)
Show SMILES [O-]C(=O)CCC(=O)Nc1ccc(NC(=O)C2CCCO2)cc1
Show InChI InChI=1S/C15H18N2O5/c18-13(7-8-14(19)20)16-10-3-5-11(6-4-10)17-15(21)12-2-1-9-22-12/h3-6,12H,1-2,7-9H2,(H,16,18)(H,17,21)(H,19,20)/p-1
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n/an/a 6.12E+3n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166652
PNG
(4-((4-(1H-pyrrole-2-carboxamido)phenyl)amino)-4-ox...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)C2CCCO2)cc1
Show InChI InChI=1S/C15H15N3O4/c19-13(7-8-14(20)21)17-10-3-5-11(6-4-10)18-15(22)12-2-1-9-16-12/h1-6,9,16H,7-8H2,(H,17,19)(H,18,22)(H,20,21)
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n/an/a 7.50E+3n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166648
PNG
(4-((4-(5-nitrofuran-2-carboxamido)phenyl)amino)-4-...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(o2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H13N3O7/c19-12(6-8-14(20)21)16-9-1-3-10(4-2-9)17-15(22)11-5-7-13(25-11)18(23)24/h1-5,7H,6,8H2,(H,16,19)(H,17,22)(H,20,21)
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n/an/a 8.41E+3n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166666
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)-5-methy...)
Show SMILES Cc1ccc(s1)C(=O)Nc1ccc(NC(=O)CCC(=O)NN)cc1
Show InChI InChI=1S/C16H18N4O3S/c1-10-2-7-13(24-10)16(23)19-12-5-3-11(4-6-12)18-14(21)8-9-15(22)20-17/h2-7H,8-9,17H2,1H3,(H,18,21)(H,19,23)(H,20,22)
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n/an/a 9.71E+3n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166655
PNG
(4-(4-(5-methylfuran-2-carboxamido)phenylamino)-4-o...)
Show SMILES Cc1ccc(o1)C(=O)Nc1ccc(NC(=O)CCC([O-])=O)cc1
Show InChI InChI=1S/C16H16N2O5/c1-10-2-7-13(23-10)16(22)18-12-5-3-11(4-6-12)17-14(19)8-9-15(20)21/h2-7H,8-9H2,1H3,(H,17,19)(H,18,22)(H,20,21)/p-1
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n/an/a 1.03E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166652
PNG
(4-((4-(1H-pyrrole-2-carboxamido)phenyl)amino)-4-ox...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)C2CCCO2)cc1
Show InChI InChI=1S/C15H15N3O4/c19-13(7-8-14(20)21)17-10-3-5-11(6-4-10)18-15(22)12-2-1-9-16-12/h1-6,9,16H,7-8H2,(H,17,19)(H,18,22)(H,20,21)
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n/an/a 1.11E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166649
PNG
(4-oxo-4-((4-(thiophene-2-carboxamido)phenyl)amino)...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1
Show InChI InChI=1S/C15H14N2O4S/c18-13(7-8-14(19)20)16-10-3-5-11(6-4-10)17-15(21)12-2-1-9-22-12/h1-6,9H,7-8H2,(H,16,18)(H,17,21)(H,19,20)
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n/an/a 1.12E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166661
PNG
(4-oxo-4-(4-(tetrahydrofuran-2-carboxamido)phenylam...)
Show SMILES [O-]C(=O)CCC(=O)Nc1ccc(NC(=O)C2CCCO2)cc1
Show InChI InChI=1S/C15H18N2O5/c18-13(7-8-14(19)20)16-10-3-5-11(6-4-10)17-15(21)12-2-1-9-22-12/h3-6,12H,1-2,7-9H2,(H,16,18)(H,17,21)(H,19,20)/p-1
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n/an/a 1.17E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166651
PNG
(4-((4-(5-nitrothiophene-2-carboxamido)phenyl)amino...)
Show SMILES OC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(s2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H13N3O6S/c19-12(6-8-14(20)21)16-9-1-3-10(4-2-9)17-15(22)11-5-7-13(25-11)18(23)24/h1-5,7H,6,8H2,(H,16,19)(H,17,22)(H,20,21)
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n/an/a 1.25E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166658
PNG
(4-(4-(5-methylthiophene-2-carboxamido)phenylamino)...)
Show SMILES Cc1ccc(s1)C(=O)Nc1ccc(NC(=O)CCC([O-])=O)cc1
Show InChI InChI=1S/C16H16N2O4S/c1-10-2-7-13(23-10)16(22)18-12-5-3-11(4-6-12)17-14(19)8-9-15(20)21/h2-7H,8-9H2,1H3,(H,17,19)(H,18,22)(H,20,21)/p-1
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n/an/a 1.25E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166657
PNG
(4-oxo-4-((4-(thiophene-2-carboxamido)phenyl)amino)...)
Show SMILES [O-]C(=O)CCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1
Show InChI InChI=1S/C15H14N2O4S/c18-13(7-8-14(19)20)16-10-3-5-11(6-4-10)17-15(21)12-2-1-9-22-12/h1-6,9H,7-8H2,(H,16,18)(H,17,21)(H,19,20)/p-1
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n/an/a 1.25E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166646
PNG
(4-((4-(furan-2-carboxamido)phenyl)amino)-4-oxobuta...)
Show SMILES OC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccco2)cc1
Show InChI InChI=1S/C15H14N2O5/c18-13(7-8-14(19)20)16-10-3-5-11(6-4-10)17-15(21)12-2-1-9-22-12/h1-6,9H,7-8H2,(H,16,18)(H,17,21)(H,19,20)
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n/an/a 1.29E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166653
PNG
(4-oxo-4-((4-(tetrahydrofuran-2-carboxamido)phenyl)...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc[nH]2)cc1
Show InChI InChI=1S/C16H17N3O4/c1-23-15(21)9-8-14(20)18-11-4-6-12(7-5-11)19-16(22)13-3-2-10-17-13/h2-7,10,17H,8-9H2,1H3,(H,18,20)(H,19,22)
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n/an/a 1.37E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166660
PNG
(4-(4-(1H-pyrrole-2-carboxamido)phenylamino)-4-oxob...)
Show SMILES [O-]C(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc[nH]2)cc1
Show InChI InChI=1S/C15H15N3O4/c19-13(7-8-14(20)21)17-10-3-5-11(6-4-10)18-15(22)12-2-1-9-16-12/h1-6,9,16H,7-8H2,(H,17,19)(H,18,22)(H,20,21)/p-1
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n/an/a 1.37E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166667
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)-5-nitro...)
Show SMILES NNC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(s2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H15N5O5S/c16-19-13(22)7-6-12(21)17-9-1-3-10(4-2-9)18-15(23)11-5-8-14(26-11)20(24)25/h1-5,8H,6-7,16H2,(H,17,21)(H,18,23)(H,19,22)
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n/an/a 1.93E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166657
PNG
(4-oxo-4-((4-(thiophene-2-carboxamido)phenyl)amino)...)
Show SMILES [O-]C(=O)CCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1
Show InChI InChI=1S/C15H14N2O4S/c18-13(7-8-14(19)20)16-10-3-5-11(6-4-10)17-15(21)12-2-1-9-22-12/h1-6,9H,7-8H2,(H,16,18)(H,17,21)(H,19,20)/p-1
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n/an/a 2.20E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166650
PNG
(4-((4-(5-methylthiophene-2-carboxamido)phenyl)amin...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(C)s2)cc1
Show InChI InChI=1S/C16H16N2O4S/c1-10-2-7-13(23-10)16(22)18-12-5-3-11(4-6-12)17-14(19)8-9-15(20)21/h2-7H,8-9H2,1H3,(H,17,19)(H,18,22)(H,20,21)
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n/an/a 2.26E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166648
PNG
(4-((4-(5-nitrofuran-2-carboxamido)phenyl)amino)-4-...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(o2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H13N3O7/c19-12(6-8-14(20)21)16-9-1-3-10(4-2-9)17-15(22)11-5-7-13(25-11)18(23)24/h1-5,7H,6,8H2,(H,16,19)(H,17,22)(H,20,21)
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n/an/a 2.26E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166669
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)tetrahyd...)
Show SMILES NNC(=O)CCC(=O)Nc1ccc(NC(=O)C2CCCO2)cc1
Show InChI InChI=1S/C15H20N4O4/c16-19-14(21)8-7-13(20)17-10-3-5-11(6-4-10)18-15(22)12-2-1-9-23-12/h3-6,12H,1-2,7-9,16H2,(H,17,20)(H,18,22)(H,19,21)
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n/an/a 2.31E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166662
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)furan-2-...)
Show SMILES NNC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccco2)cc1
Show InChI InChI=1S/C15H16N4O4/c16-19-14(21)8-7-13(20)17-10-3-5-11(6-4-10)18-15(22)12-2-1-9-23-12/h1-6,9H,7-8,16H2,(H,17,20)(H,18,22)(H,19,21)
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n/an/a 2.39E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166658
PNG
(4-(4-(5-methylthiophene-2-carboxamido)phenylamino)...)
Show SMILES Cc1ccc(s1)C(=O)Nc1ccc(NC(=O)CCC([O-])=O)cc1
Show InChI InChI=1S/C16H16N2O4S/c1-10-2-7-13(23-10)16(22)18-12-5-3-11(4-6-12)17-14(19)8-9-15(20)21/h2-7H,8-9H2,1H3,(H,17,19)(H,18,22)(H,20,21)/p-1
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n/an/a 2.47E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166653
PNG
(4-oxo-4-((4-(tetrahydrofuran-2-carboxamido)phenyl)...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc[nH]2)cc1
Show InChI InChI=1S/C16H17N3O4/c1-23-15(21)9-8-14(20)18-11-4-6-12(7-5-11)19-16(22)13-3-2-10-17-13/h2-7,10,17H,8-9H2,1H3,(H,18,20)(H,19,22)
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n/an/a 2.49E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166664
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)-5-nitro...)
Show SMILES NNC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(o2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H15N5O6/c16-19-13(22)7-6-12(21)17-9-1-3-10(4-2-9)18-15(23)11-5-8-14(26-11)20(24)25/h1-5,8H,6-7,16H2,(H,17,21)(H,18,23)(H,19,22)
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n/an/a 2.51E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166656
PNG
(4-(4-(5-nitrofuran-2-carboxamido)phenylamino)-4-ox...)
Show SMILES [O-]C(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(o2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H13N3O7/c19-12(6-8-14(20)21)16-9-1-3-10(4-2-9)17-15(22)11-5-7-13(25-11)18(23)24/h1-5,7H,6,8H2,(H,16,19)(H,17,22)(H,20,21)/p-1
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n/an/a 2.58E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166647
PNG
(4-((4-(5-methylfuran-2-carboxamido)phenyl)amino)-4...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(C)o2)cc1
Show InChI InChI=1S/C16H16N2O5/c1-10-2-7-13(23-10)16(22)18-12-5-3-11(4-6-12)17-14(19)8-9-15(20)21/h2-7H,8-9H2,1H3,(H,17,19)(H,18,22)(H,20,21)
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n/an/a 2.62E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166667
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)-5-nitro...)
Show SMILES NNC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(s2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H15N5O5S/c16-19-13(22)7-6-12(21)17-9-1-3-10(4-2-9)18-15(23)11-5-8-14(26-11)20(24)25/h1-5,8H,6-7,16H2,(H,17,21)(H,18,23)(H,19,22)
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n/an/a 2.64E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166659
PNG
(4-(4-(5-nitrothiophene-2-carboxamido)phenylamino)-...)
Show SMILES [O-]C(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(s2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H13N3O6S/c19-12(6-8-14(20)21)16-9-1-3-10(4-2-9)17-15(22)11-5-7-13(25-11)18(23)24/h1-5,7H,6,8H2,(H,16,19)(H,17,22)(H,20,21)/p-1
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n/an/a 2.68E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166647
PNG
(4-((4-(5-methylfuran-2-carboxamido)phenyl)amino)-4...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(C)o2)cc1
Show InChI InChI=1S/C16H16N2O5/c1-10-2-7-13(23-10)16(22)18-12-5-3-11(4-6-12)17-14(19)8-9-15(20)21/h2-7H,8-9H2,1H3,(H,17,19)(H,18,22)(H,20,21)
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n/an/a 2.76E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166665
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)thiophen...)
Show SMILES NNC(=O)CCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1
Show InChI InChI=1S/C15H16N4O3S/c16-19-14(21)8-7-13(20)17-10-3-5-11(6-4-10)18-15(22)12-2-1-9-23-12/h1-6,9H,7-8,16H2,(H,17,20)(H,18,22)(H,19,21)
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n/an/a 2.81E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166654
PNG
(4-((4-(furan-2-carboxamido)phenyl)amino)-4-oxobuta...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccco2)cc1
Show InChI InChI=1S/C15H14N2O5/c18-13(7-8-14(19)20)16-10-3-5-11(6-4-10)17-15(21)12-2-1-9-22-12/h1-6,9H,7-8H2,(H,16,18)(H,17,21)(H,19,20)/p-1
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n/an/a 2.82E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166656
PNG
(4-(4-(5-nitrofuran-2-carboxamido)phenylamino)-4-ox...)
Show SMILES [O-]C(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(o2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H13N3O7/c19-12(6-8-14(20)21)16-9-1-3-10(4-2-9)17-15(22)11-5-7-13(25-11)18(23)24/h1-5,7H,6,8H2,(H,16,19)(H,17,22)(H,20,21)/p-1
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n/an/a 2.89E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166659
PNG
(4-(4-(5-nitrothiophene-2-carboxamido)phenylamino)-...)
Show SMILES [O-]C(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(s2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H13N3O6S/c19-12(6-8-14(20)21)16-9-1-3-10(4-2-9)17-15(22)11-5-7-13(25-11)18(23)24/h1-5,7H,6,8H2,(H,16,19)(H,17,22)(H,20,21)/p-1
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n/an/a 2.95E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166665
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)thiophen...)
Show SMILES NNC(=O)CCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1
Show InChI InChI=1S/C15H16N4O3S/c16-19-14(21)8-7-13(20)17-10-3-5-11(6-4-10)18-15(22)12-2-1-9-23-12/h1-6,9H,7-8,16H2,(H,17,20)(H,18,22)(H,19,21)
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n/an/a 3.26E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166664
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)-5-nitro...)
Show SMILES NNC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(o2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C15H15N5O6/c16-19-13(22)7-6-12(21)17-9-1-3-10(4-2-9)18-15(23)11-5-8-14(26-11)20(24)25/h1-5,8H,6-7,16H2,(H,17,21)(H,18,23)(H,19,22)
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n/an/a 3.55E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166650
PNG
(4-((4-(5-methylthiophene-2-carboxamido)phenyl)amin...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc(C)s2)cc1
Show InChI InChI=1S/C16H16N2O4S/c1-10-2-7-13(23-10)16(22)18-12-5-3-11(4-6-12)17-14(19)8-9-15(20)21/h2-7H,8-9H2,1H3,(H,17,19)(H,18,22)(H,20,21)
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n/an/a 3.75E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166649
PNG
(4-oxo-4-((4-(thiophene-2-carboxamido)phenyl)amino)...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2cccs2)cc1
Show InChI InChI=1S/C15H14N2O4S/c18-13(7-8-14(19)20)16-10-3-5-11(6-4-10)17-15(21)12-2-1-9-22-12/h1-6,9H,7-8H2,(H,16,18)(H,17,21)(H,19,20)
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n/an/a 3.76E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166662
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)furan-2-...)
Show SMILES NNC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccco2)cc1
Show InChI InChI=1S/C15H16N4O4/c16-19-14(21)8-7-13(20)17-10-3-5-11(6-4-10)18-15(22)12-2-1-9-23-12/h1-6,9H,7-8,16H2,(H,17,20)(H,18,22)(H,19,21)
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n/an/a 3.94E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166669
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)tetrahyd...)
Show SMILES NNC(=O)CCC(=O)Nc1ccc(NC(=O)C2CCCO2)cc1
Show InChI InChI=1S/C15H20N4O4/c16-19-14(21)8-7-13(20)17-10-3-5-11(6-4-10)18-15(22)12-2-1-9-23-12/h3-6,12H,1-2,7-9,16H2,(H,17,20)(H,18,22)(H,19,21)
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n/an/a 4.12E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166660
PNG
(4-(4-(1H-pyrrole-2-carboxamido)phenylamino)-4-oxob...)
Show SMILES [O-]C(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc[nH]2)cc1
Show InChI InChI=1S/C15H15N3O4/c19-13(7-8-14(20)21)17-10-3-5-11(6-4-10)18-15(22)12-2-1-9-16-12/h1-6,9,16H,7-8H2,(H,17,19)(H,18,22)(H,20,21)/p-1
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n/an/a 4.25E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166668
PNG
(N-(4-(4-Hydrazinyl-4-oxobutanamido)phenyl)-1H-pyrr...)
Show SMILES NNC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccc[nH]2)cc1
Show InChI InChI=1S/C15H17N5O3/c16-20-14(22)8-7-13(21)18-10-3-5-11(6-4-10)19-15(23)12-2-1-9-17-12/h1-6,9,17H,7-8,16H2,(H,18,21)(H,19,23)(H,20,22)
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n/an/a 4.31E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Supercoiling assay was performed using the commercially available kit (DNA gyrase supercoiling assay kit: SAS4001) from Inspiralis Pvt.limited, Norwi...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
DNA gyrase subunit B (DNA gyraseB)


(Staphylococcus aureus (Firmicutes))
BDBM166654
PNG
(4-((4-(furan-2-carboxamido)phenyl)amino)-4-oxobuta...)
Show SMILES COC(=O)CCC(=O)Nc1ccc(NC(=O)c2ccco2)cc1
Show InChI InChI=1S/C15H14N2O5/c18-13(7-8-14(19)20)16-10-3-5-11(6-4-10)17-15(21)12-2-1-9-22-12/h1-6,9H,7-8H2,(H,16,18)(H,17,21)(H,19,20)/p-1
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n/an/a 4.54E+4n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5然 each of E. coli gyraseA and S. aureus gyraseB were incubated for a period of 45 min with salmon sperm ...


Chem Biol Drug Des 86: 918-25 (2015)


Article DOI: 10.1111/cbdd.12529
BindingDB Entry DOI: 10.7270/Q2610Z29
More data for this
Ligand-Target Pair
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