BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'DNA gyrase subunit A/B' and Ligand = 'BDBM159897'   
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 gyrase subunit A/B


(Escherichia coli (strain K12))
BDBM159897
PNG
(BDBM159898 | US9040528, 53)
Show SMILES C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)-n2cncn2)C(=O)NC(=O)NC1=O |r|
Show InChI InChI=1S/C20H18FN7O5/c1-8-5-27-13-10(3-11-14(12(13)21)33-26-16(11)28-7-22-6-23-28)4-20(15(27)9(2)32-8)17(29)24-19(31)25-18(20)30/h3,6-9,15H,4-5H2,1-2H3,(H2,24,25,29,30,31)/t8-,9+,15-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 200n/an/an/an/a7.5n/a



AstraZeneca AB

US Patent


Assay Description
In a black, 384-well polystyrene assay plate, 30 microliters/well of 5 nM Escherichia coli DNA gyrase A/B tetramer and 130 micrograms/ml of topologic...


US Patent US9040528 (2015)


BindingDB Entry DOI: 10.7270/Q2PG1QG0
More data for this
Ligand-Target Pair
DNA gyrase subunit A/B


(Staphylococcus aureus)
BDBM159897
PNG
(BDBM159898 | US9040528, 53)
Show SMILES C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)-n2cncn2)C(=O)NC(=O)NC1=O |r|
Show InChI InChI=1S/C20H18FN7O5/c1-8-5-27-13-10(3-11-14(12(13)21)33-26-16(11)28-7-22-6-23-28)4-20(15(27)9(2)32-8)17(29)24-19(31)25-18(20)30/h3,6-9,15H,4-5H2,1-2H3,(H2,24,25,29,30,31)/t8-,9+,15-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00266
BindingDB Entry DOI: 10.7270/Q2C251HR
More data for this
Ligand-Target Pair
DNA gyrase subunit A/B


(Escherichia coli (strain K12))
BDBM159897
PNG
(BDBM159898 | US9040528, 53)
Show SMILES C[C@@H]1CN2[C@H]([C@H](C)O1)C1(Cc3cc4c(noc4c(F)c23)-n2cncn2)C(=O)NC(=O)NC1=O |r|
Show InChI InChI=1S/C20H18FN7O5/c1-8-5-27-13-10(3-11-14(12(13)21)33-26-16(11)28-7-22-6-23-28)4-20(15(27)9(2)32-8)17(29)24-19(31)25-18(20)30/h3,6-9,15H,4-5H2,1-2H3,(H2,24,25,29,30,31)/t8-,9+,15-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 2.80E+3n/an/an/an/a7.5n/a



AstraZeneca AB

US Patent


Assay Description
In a black, 384-well polystyrene assay plate, 30 microliters/well of 5 nM Escherichia coli DNA gyrase A/B tetramer and 130 micrograms/ml of topologic...


US Patent US9040528 (2015)


BindingDB Entry DOI: 10.7270/Q2PG1QG0
More data for this
Ligand-Target Pair