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Found 1 hit Enz. Inhib. hit(s) with Target = 'Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI [9-251]' and Ligand = 'BDBM50052241'   
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
Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI [9-251]


(Staphylococcus aureus)		BDBM50052241
PNG
(CHEMBL3322728)
Show SMILES CN1Cc2cc(\C=C\C(=O)N3CC(C3)c3oc4ccccc4c3C)cnc2NC(=O)C1
Show InChI InChI=1S/C24H24N4O3/c1-15-19-5-3-4-6-20(19)31-23(15)18-12-28(13-18)22(30)8-7-16-9-17-11-27(2)14-21(29)26-24(17)25-10-16/h3-10,18H,11-14H2,1-2H3,(H,25,26,29)/b8-7+
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Similars
Article
PubMed
n/an/a 112n/an/an/an/an/an/a



Aurigene Discovery Technologies Ltd

Curated by ChEMBL


Assay Description
Inhibition of Staphylococcus aureus FabI-mediated reduction of enoyl-ACP preincubated for 30 mins measured after 2 hrs by spectrophotometry

Eur J Med Chem 84: 382-94 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.036
BindingDB Entry DOI: 10.7270/Q2CJ8G45
More data for this
Ligand-Target Pair