Compile Data Set for Download or QSAR

Found 28 hits of ic50 data for polymerid = 50005737   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM8726 (5-chloro-2-(2,4-dichlorophenoxy)phenol | CHEMBL849...) Show SMILES Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl Show InChI InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair				3D Structure (crystal)
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377104 (CHEMBL259629) Show SMILES O=c1[nH]c(OCc2ccccc2)ccc1Cc1ccccc1 Show InChI InChI=1S/C19H17NO2/c21-19-17(13-15-7-3-1-4-8-15)11-12-18(20-19)22-14-16-9-5-2-6-10-16/h1-12H,13-14H2,(H,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377084 (CHEMBL260770) Show SMILES Nc1ccc(Cn2ccc(OCc3ccccc3)cc2=O)c(Cl)c1 Show InChI InChI=1S/C19H17ClN2O2/c20-18-10-16(21)7-6-15(18)12-22-9-8-17(11-19(22)23)24-13-14-4-2-1-3-5-14/h1-11H,12-13,21H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377089 (CHEMBL261638) Show SMILES Clc1ccccc1Cn1ccc(OCCCn2ccc3ccccc23)cc1=O Show InChI InChI=1S/C23H21ClN2O2/c24-21-8-3-1-7-19(21)17-26-14-11-20(16-23(26)27)28-15-5-12-25-13-10-18-6-2-4-9-22(18)25/h1-4,6-11,13-14,16H,5,12,15,17H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377090 (CHEMBL261348) Show SMILES Clc1ccccc1Cn1ccc(OCc2ccc3ccccc3c2)cc1=O Show InChI InChI=1S/C23H18ClNO2/c24-22-8-4-3-7-20(22)15-25-12-11-21(14-23(25)26)27-16-17-9-10-18-5-1-2-6-19(18)13-17/h1-14H,15-16H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377091 (CHEMBL260368) Show SMILES Clc1ccccc1Cn1ccc(OCc2cccc3ccccc23)cc1=O Show InChI InChI=1S/C23H18ClNO2/c24-22-11-4-2-7-18(22)15-25-13-12-20(14-23(25)26)27-16-19-9-5-8-17-6-1-3-10-21(17)19/h1-14H,15-16H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50326326 (1-(2-chlorobenzyl)-4-(benzyloxy)pyridin-2(1H)-one ...) Show SMILES Clc1ccccc1Cn1ccc(OCc2ccccc2)cc1=O Show InChI InChI=1S/C19H16ClNO2/c20-18-9-5-4-8-16(18)13-21-11-10-17(12-19(21)22)23-14-15-6-2-1-3-7-15/h1-12H,13-14H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377088 (CHEMBL261420) Show SMILES Clc1ccccc1Cn1ccc(OCCCn2nnc3ccccc23)cc1=O Show InChI InChI=1S/C21H19ClN4O2/c22-18-7-2-1-6-16(18)15-25-12-10-17(14-21(25)27)28-13-5-11-26-20-9-4-3-8-19(20)23-24-26/h1-4,6-10,12,14H,5,11,13,15H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377105 (CHEMBL259268) Show SMILES CC(=O)Nc1ccc(Cn2ccc(OCc3ccccc3)cc2=O)c(Cl)c1 Show InChI InChI=1S/C21H19ClN2O3/c1-15(25)23-18-8-7-17(20(22)11-18)13-24-10-9-19(12-21(24)26)27-14-16-5-3-2-4-6-16/h2-12H,13-14H2,1H3,(H,23,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377092 (CHEMBL403703) Show SMILES Clc1ccccc1Cn1ccc(OCc2ccc(cc2)C#N)cc1=O Show InChI InChI=1S/C20H15ClN2O2/c21-19-4-2-1-3-17(19)13-23-10-9-18(11-20(23)24)25-14-16-7-5-15(12-22)6-8-16/h1-11H,13-14H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377097 (CHEMBL260257) Show SMILES COc1ccc(Cn2ccc(OCCCn3c4ccccc4c4ccccc34)cc2=O)cc1 Show InChI InChI=1S/C28H26N2O3/c1-32-22-13-11-21(12-14-22)20-29-17-15-23(19-28(29)31)33-18-6-16-30-26-9-4-2-7-24(26)25-8-3-5-10-27(25)30/h2-5,7-15,17,19H,6,16,18,20H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377086 (CHEMBL261109) Show SMILES NC(=O)c1ccc(Cn2ccc(OCc3ccccc3)cc2=O)c(Cl)c1 Show InChI InChI=1S/C20H17ClN2O3/c21-18-10-15(20(22)25)6-7-16(18)12-23-9-8-17(11-19(23)24)26-13-14-4-2-1-3-5-14/h1-11H,12-13H2,(H2,22,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50326325 (1-(2-chloro-4-nitrobenzyl)-4-(benzyloxy)pyridin-2(...) Show SMILES [O-][N+](=O)c1ccc(Cn2ccc(OCc3ccccc3)cc2=O)c(Cl)c1 Show InChI InChI=1S/C19H15ClN2O4/c20-18-10-16(22(24)25)7-6-15(18)12-21-9-8-17(11-19(21)23)26-13-14-4-2-1-3-5-14/h1-11H,12-13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50326324 (1-(2-chlorobenzyl)-4-(3-(9H-carbazol-9-yl)propoxy)...) Show SMILES Clc1ccccc1Cn1ccc(OCCCn2c3ccccc3c3ccccc23)cc1=O Show InChI InChI=1S/C27H23ClN2O2/c28-24-11-4-1-8-20(24)19-29-16-14-21(18-27(29)31)32-17-7-15-30-25-12-5-2-9-22(25)23-10-3-6-13-26(23)30/h1-6,8-14,16,18H,7,15,17,19H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50240029 (1-benzyl-4-(benzyloxy)pyridin-2(1H)-one | CHEMBL26...) Show SMILES O=c1cc(OCc2ccccc2)ccn1Cc1ccccc1 Show InChI InChI=1S/C19H17NO2/c21-19-13-18(22-15-17-9-5-2-6-10-17)11-12-20(19)14-16-7-3-1-4-8-16/h1-13H,14-15H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50326328 (4-((4-(benzyloxy)-2-oxopyridin-1(2H)-yl)methyl)-3-...) Show SMILES Clc1cc(ccc1Cn1ccc(OCc2ccccc2)cc1=O)C#N Show InChI InChI=1S/C20H15ClN2O2/c21-19-10-16(12-22)6-7-17(19)13-23-9-8-18(11-20(23)24)25-14-15-4-2-1-3-5-15/h1-11H,13-14H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377103 (CHEMBL259630) Show SMILES COc1ccc(Oc2ccccc2Cl)c(=O)[nH]1 Show InChI InChI=1S/C12H10ClNO3/c1-16-11-7-6-10(12(15)14-11)17-9-5-3-2-4-8(9)13/h2-7H,1H3,(H,14,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.88E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377102 (CHEMBL259937) Show SMILES [O-][n+]1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl Show InChI InChI=1S/C11H6Cl3NO2/c12-7-1-3-10(9(14)5-7)17-11-4-2-8(13)6-15(11)16/h1-6H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377100 (CHEMBL260652) Show SMILES COc1ccc(Oc2ccc(Cl)cc2Cl)c(=O)[nH]1 Show InChI InChI=1S/C12H9Cl2NO3/c1-17-11-5-4-10(12(16)15-11)18-9-3-2-7(13)6-8(9)14/h2-6H,1H3,(H,15,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.37E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377085 (CHEMBL260915) Show SMILES OC(=O)c1ccc(Cn2ccc(OCc3ccccc3)cc2=O)c(Cl)c1 Show InChI InChI=1S/C20H16ClNO4/c21-18-10-15(20(24)25)6-7-16(18)12-22-9-8-17(11-19(22)23)26-13-14-4-2-1-3-5-14/h1-11H,12-13H2,(H,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377087 (CHEMBL261637) Show SMILES Clc1ccccc1Cn1ccc(OCCCn2ccnc2)cc1=O Show InChI InChI=1S/C18H18ClN3O2/c19-17-5-2-1-4-15(17)13-22-9-6-16(12-18(22)23)24-11-3-8-21-10-7-20-14-21/h1-2,4-7,9-10,12,14H,3,8,11,13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377101 (CHEMBL255941) Show SMILES Oc1ccn(Cc2ccccc2)c(=O)c1 Show InChI InChI=1S/C12H11NO2/c14-11-6-7-13(12(15)8-11)9-10-4-2-1-3-5-10/h1-8,14H,9H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377099 (CHEMBL255518) Show SMILES COc1ccc(Cn2ccc(O)cc2=O)cc1 Show InChI InChI=1S/C13H13NO3/c1-17-12-4-2-10(3-5-12)9-14-7-6-11(15)8-13(14)16/h2-8,15H,9H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377098 (CHEMBL262591) Show SMILES Oc1ccc(Cn2ccc(O)cc2=O)cc1 Show InChI InChI=1S/C12H11NO3/c14-10-3-1-9(2-4-10)8-13-6-5-11(15)7-12(13)16/h1-7,14-15H,8H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377096 (CHEMBL260418) Show SMILES O=c1cc(OCCCn2c3ccccc3c3ccccc23)ccn1Cc1ccccc1 Show InChI InChI=1S/C27H24N2O2/c30-27-19-22(15-17-28(27)20-21-9-2-1-3-10-21)31-18-8-16-29-25-13-6-4-11-23(25)24-12-5-7-14-26(24)29/h1-7,9-15,17,19H,8,16,18,20H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377095 (CHEMBL259486) Show SMILES O=c1cc(OCc2ccccc2)ccn1CC#C Show InChI InChI=1S/C15H13NO2/c1-2-9-16-10-8-14(11-15(16)17)18-12-13-6-4-3-5-7-13/h1,3-8,10-11H,9,12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377093 (CHEMBL406046) Show SMILES COc1ccc(Oc2ccccc2Cl)c[n+]1[O-] Show InChI InChI=1S/C12H10ClNO3/c1-16-12-7-6-9(8-14(12)15)17-11-5-3-2-4-10(11)13/h2-8H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADH] FabI (Bacillus subtilis (strain 168))	BDBM50377094 (CHEMBL407637) Show SMILES CCOC(=O)c1cc(Cn2ccc(OCc3ccccc3)cc2=O)on1 Show InChI InChI=1S/C19H18N2O5/c1-2-24-19(23)17-10-16(26-20-17)12-21-9-8-15(11-18(21)22)25-13-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis Enoyl ACP reductase				Bioorg Med Chem Lett 18: 3565-9 (2008) Article DOI: 10.1016/j.bmcl.2008.05.004 BindingDB Entry DOI: 10.7270/Q2668F39
					More data for this Ligand-Target Pair