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Found 1 hit Enz. Inhib. hit(s) with Target = 'Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI [9-251]' and Ligand = 'BDBM50052240'   
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)		BDBM50052240
PNG
(CHEMBL3322727)
Show SMILES Cc1c(oc2ccccc12)C1CN(C1)C(=O)\C=C\c1cnc2NC(=O)CNCc2c1
Show InChI InChI=1S/C23H22N4O3/c1-14-18-4-2-3-5-19(18)30-22(14)17-12-27(13-17)21(29)7-6-15-8-16-10-24-11-20(28)26-23(16)25-9-15/h2-9,17,24H,10-13H2,1H3,(H,25,26,28)/b7-6+
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Similars
Article
PubMed
n/an/a 384n/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