Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI' and Ligand = 'BDBM133674'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI (Staphylococcus aureus)	BDBM133674 (US8846711, 18 | US9051321, 18) Show SMILES O=C(\C=C\c1cnc2NC(=O)CCc2c1)N1CCCC[C@@H]1c1nc2ccccc2o1 |r| Show InChI InChI=1S/C23H22N4O3/c28-20-10-9-16-13-15(14-24-22(16)26-20)8-11-21(29)27-12-4-3-6-18(27)23-25-17-5-1-2-7-19(17)30-23/h1-2,5,7-8,11,13-14,18H,3-4,6,9-10,12H2,(H,24,26,28)/b11-8+/t18-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	6.5	25
FAB PHARMA S.A.S. US Patent					Assay Description The assay buffer "AB" contained 50 mM ADA (N-(2-acetamido)iminodiacetic acid monosodium salt) pH 6.5, 1 mM dithiothreitol, 0.006% Triton-X100 and 50 ...				US Patent US9051321 (2015) BindingDB Entry DOI: 10.7270/Q2WW7GDG
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI (Staphylococcus aureus)	BDBM133674 (US8846711, 18 | US9051321, 18) Show SMILES O=C(\C=C\c1cnc2NC(=O)CCc2c1)N1CCCC[C@@H]1c1nc2ccccc2o1 |r| Show InChI InChI=1S/C23H22N4O3/c28-20-10-9-16-13-15(14-24-22(16)26-20)8-11-21(29)27-12-4-3-6-18(27)23-25-17-5-1-2-7-19(17)30-23/h1-2,5,7-8,11,13-14,18H,3-4,6,9-10,12H2,(H,24,26,28)/b11-8+/t18-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	6.5	25
Fab Pharma S.A.S. US Patent					Assay Description Compound inhibitory activity of FabI enzyme is measured in vitro by the IC5 so determination using a fluorescence based assay.The protein FabI from S...				US Patent US8846711 (2014) BindingDB Entry DOI: 10.7270/Q2QN65FV
					More data for this Ligand-Target Pair