BindingDB logo
myBDB logout

BDBM166661 4-oxo-4-(4-(tetrahydrofuran-2-carboxamido)phenylamino)butanoate (20)

SMILES: [O-]C(=O)CCC(=O)Nc1ccc(NC(=O)C2CCCO2)cc1

InChI Key: InChIKey=GKIGTEYOPIADIY-UHFFFAOYNA-M

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 166661   
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))
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=1/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
PDB

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.12E+3n/an/an/an/a7.625



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=1/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
PDB

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.17E+4n/an/an/an/a7.5n/a



Birla Institute of Technology & Science-Pilani, Hyderabad Campus



Assay Description
Initially, equimolar quantities of about 0.5ÁM 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