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SMILES: Cl.COC(=O)CNC(=O)c1ccc(NC(=O)c2[nH]c(C)c(Cl)c2Cl)c(O[C@H]2CCNC2)c1

InChI Key: InChIKey=FFVNHKQONMKRRU-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50249801   
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 A/B


(Escherichia coli (strain K12))
BDBM50249801
PNG
(CHEMBL4793836)
Show SMILES Cl.COC(=O)CNC(=O)c1ccc(NC(=O)c2[nH]c(C)c(Cl)c2Cl)c(O[C@H]2CCNC2)c1 |r|
Show InChI InChI=1S/C17H16N2O4S/c1-19-15-11-16(23-2)14(10-12(15)8-9-17(19)20)18-24(21,22)13-6-4-3-5-7-13/h3-11,18H,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 74n/an/an/an/an/an/a


TBA

Assay Description
Evaluated for the percent binding affinity against H1 receptor by an H1 histamine-mediated bronchospasm


Citation and Details
More data for this
Ligand-Target Pair
DNA gyrase subunit A/B


(Staphylococcus aureus)
BDBM50249801
PNG
(CHEMBL4793836)
Show SMILES Cl.COC(=O)CNC(=O)c1ccc(NC(=O)c2[nH]c(C)c(Cl)c2Cl)c(O[C@H]2CCNC2)c1 |r|
Show InChI InChI=1S/C17H16N2O4S/c1-19-15-11-16(23-2)14(10-12(15)8-9-17(19)20)18-24(21,22)13-6-4-3-5-7-13/h3-11,18H,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 950n/an/an/an/an/an/a


TBA

Assay Description
Evaluated for the percent binding affinity against H1 receptor by an H1 histamine-mediated bronchospasm


Citation and Details
More data for this
Ligand-Target Pair