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BDBM23616 2-benzoylamino benzoic acid deriv., 28j::2-{[3-(4-fluorophenoxy)benzene]amido}benzoic acid

SMILES: OC(=O)c1ccccc1NC(=O)c1cccc(Oc2ccc(F)cc2)c1

InChI Key: InChIKey=HPTXSHNYGZHJLA-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 23616   
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
beta-Ketoacyl-ACP Synthase III (FabH)


(Enterococcus faecalis)
BDBM23616
PNG
(2-benzoylamino benzoic acid deriv., 28j | 2-{[3-(4...)
Show SMILES OC(=O)c1ccccc1NC(=O)c1cccc(Oc2ccc(F)cc2)c1
Show InChI InChI=1S/C20H14FNO4/c21-14-8-10-15(11-9-14)26-16-5-3-4-13(12-16)19(23)22-18-7-2-1-6-17(18)20(24)25/h1-12H,(H,22,23)(H,24,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



Shri G.S. Institute of Technology and Science

Curated by ChEMBL


Assay Description
Inhibition of Enterococcus faecalis FabH by FabD/FabH coupled assay


Eur J Med Chem 43: 1071-80 (2008)


Article DOI: 10.1016/j.ejmech.2007.06.018
BindingDB Entry DOI: 10.7270/Q2GQ700V
More data for this
Ligand-Target Pair
beta-Ketoacyl-ACP Synthase III (FabH)


(Enterococcus faecalis)
BDBM23616
PNG
(2-benzoylamino benzoic acid deriv., 28j | 2-{[3-(4...)
Show SMILES OC(=O)c1ccccc1NC(=O)c1cccc(Oc2ccc(F)cc2)c1
Show InChI InChI=1S/C20H14FNO4/c21-14-8-10-15(11-9-14)26-16-5-3-4-13(12-16)19(23)22-18-7-2-1-6-17(18)20(24)25/h1-12H,(H,22,23)(H,24,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



Quorex Pharmaceuticals Inc.



Assay Description
The potency of FabH inhibition (IC50) was determined using [3H]- or [14C]-radiolabeled substrates. This was accomplished at fixed concentrations of a...


J Med Chem 48: 1596-609 (2005)


Article DOI: 10.1021/jm049141s
BindingDB Entry DOI: 10.7270/Q22B8W9H
More data for this
Ligand-Target Pair