Compile Data Set for Download or QSAR

Found 162 hits with Last Name = 'fosberry' and Initial = 'ap'   

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
Methionine--tRNA ligase, cytoplasmic (Homo sapiens (Human))	BDBM50112575 (2-[3-(6,8-Dibromo-1,2,3,4-tetrahydro-quinolin-4-yl...) Show SMILES Oc1cc(NCCCNC2CCNc3c(Br)cc(Br)cc23)nc2ccccc12 Show InChI InChI=1S/C21H22Br2N4O/c22-13-10-15-17(6-9-26-21(15)16(23)11-13)24-7-3-8-25-20-12-19(28)14-4-1-2-5-18(14)27-20/h1-2,4-5,10-12,17,24,26H,3,6-9H2,(H2,25,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory concentration against Methionyl-tRNA synthetase in a pyrophosphate exchange assay				J Med Chem 45: 1959-62 (2002) BindingDB Entry DOI: 10.7270/Q2HQ3Z6X
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18116 (2-[2-({[(2R)-2-(4-bromothiophen-2-yl)-2-hydroxyeth...) Show SMILES OCCOc1ccccc1CNC[C@@H](O)c1cc(Br)cs1 |r| Show InChI InChI=1S/C15H18BrNO3S/c16-12-7-15(21-10-12)13(19)9-17-8-11-3-1-2-4-14(11)20-6-5-18/h1-4,7,10,13,17-19H,5-6,8-9H2/t13-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.70	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18093 (2-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES OCCOc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C15H18BrNO3S/c16-12-7-15(21-10-12)13(19)9-17-8-11-3-1-2-4-14(11)20-6-5-18/h1-4,7,10,13,17-19H,5-6,8-9H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18098 (2-({[2-(benzyloxy)phenyl]methyl}amino)-1-(4-bromot...) Show SMILES OC(CNCc1ccccc1OCc1ccccc1)c1cc(Br)cs1 Show InChI InChI=1S/C20H20BrNO2S/c21-17-10-20(25-14-17)18(23)12-22-11-16-8-4-5-9-19(16)24-13-15-6-2-1-3-7-15/h1-10,14,18,22-23H,11-13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Methionine--tRNA ligase, cytoplasmic (Homo sapiens (Human))	BDBM50112577 (2-[3-(6-Ethyl-8-iodo-1,2,3,4-tetrahydro-quinolin-4...) Show SMILES CCc1cc(I)c2NCCC(NCCCNc3cc(O)c4ccccc4n3)c2c1 Show InChI InChI=1S/C23H27IN4O/c1-2-15-12-17-19(8-11-27-23(17)18(24)13-15)25-9-5-10-26-22-14-21(29)16-6-3-4-7-20(16)28-22/h3-4,6-7,12-14,19,25,27H,2,5,8-11H2,1H3,(H2,26,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory concentration against Staphylococcus aureus Methionyl-tRNA synthetase				J Med Chem 45: 1959-62 (2002) BindingDB Entry DOI: 10.7270/Q2HQ3Z6X
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18102 (1-(4-bromothiophen-2-yl)-2-({[2-(pyridin-4-ylmetho...) Show SMILES OC(CNCc1ccccc1OCc1ccncc1)c1cc(Br)cs1 Show InChI InChI=1S/C19H19BrN2O2S/c20-16-9-19(25-13-16)17(23)11-22-10-15-3-1-2-4-18(15)24-12-14-5-7-21-8-6-14/h1-9,13,17,22-23H,10-12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18101 (1-(4-bromothiophen-2-yl)-2-({[2-(pyridin-3-ylmetho...) Show SMILES OC(CNCc1ccccc1OCc1cccnc1)c1cc(Br)cs1 Show InChI InChI=1S/C19H19BrN2O2S/c20-16-8-19(25-13-16)17(23)11-22-10-15-5-1-2-6-18(15)24-12-14-4-3-7-21-9-14/h1-9,13,17,22-23H,10-12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18097 (1-(4-bromothiophen-2-yl)-2-({[2-(prop-2-en-1-yloxy...) Show SMILES OC(CNCc1ccccc1OCC=C)c1cc(Br)cs1 Show InChI InChI=1S/C16H18BrNO2S/c1-2-7-20-15-6-4-3-5-12(15)9-18-10-14(19)16-8-13(17)11-21-16/h2-6,8,11,14,18-19H,1,7,9-10H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18096 (1-(4-bromothiophen-2-yl)-2-[({2-[2-(morpholin-4-yl...) Show SMILES OC(CNCc1ccccc1OCCN1CCOCC1)c1cc(Br)cs1 Show InChI InChI=1S/C19H25BrN2O3S/c20-16-11-19(26-14-16)17(23)13-21-12-15-3-1-2-4-18(15)25-10-7-22-5-8-24-9-6-22/h1-4,11,14,17,21,23H,5-10,12-13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18114 (2-({[2-(4-aminobutoxy)phenyl]methyl}amino)-1-(4-br...) Show SMILES NCCCCOc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C17H23BrN2O2S/c18-14-9-17(23-12-14)15(21)11-20-10-13-5-1-2-6-16(13)22-8-4-3-7-19/h1-2,5-6,9,12,15,20-21H,3-4,7-8,10-11,19H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18110 (3-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES CN(CCO)C(=O)CCOc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C19H25BrN2O4S/c1-22(7-8-23)19(25)6-9-26-17-5-3-2-4-14(17)11-21-12-16(24)18-10-15(20)13-27-18/h2-5,10,13,16,21,23-24H,6-9,11-12H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18103 (2-({[2-(1H-1,3-benzodiazol-2-ylmethoxy)phenyl]meth...) Show SMILES OC(CNCc1ccccc1OCc1nc2ccccc2[nH]1)c1cc(Br)cs1 Show InChI InChI=1S/C21H20BrN3O2S/c22-15-9-20(28-13-15)18(26)11-23-10-14-5-1-4-8-19(14)27-12-21-24-16-6-2-3-7-17(16)25-21/h1-9,13,18,23,26H,10-12H2,(H,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18113 (4-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES CN(CCO)C(=O)CCCOc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C20H27BrN2O4S/c1-23(8-9-24)20(26)7-4-10-27-18-6-3-2-5-15(18)12-22-13-17(25)19-11-16(21)14-28-19/h2-3,5-6,11,14,17,22,24-25H,4,7-10,12-13H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18099 (1-(4-bromothiophen-2-yl)-2-[({2-[(4-methanesulfony...) Show SMILES CS(=O)(=O)c1ccc(COc2ccccc2CNCC(O)c2cc(Br)cs2)cc1 Show InChI InChI=1S/C21H22BrNO4S2/c1-29(25,26)18-8-6-15(7-9-18)13-27-20-5-3-2-4-16(20)11-23-12-19(24)21-10-17(22)14-28-21/h2-10,14,19,23-24H,11-13H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18112 (4-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES CNC(=O)CNC(=O)CCCOc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C20H26BrN3O4S/c1-22-20(27)12-24-19(26)7-4-8-28-17-6-3-2-5-14(17)10-23-11-16(25)18-9-15(21)13-29-18/h2-3,5-6,9,13,16,23,25H,4,7-8,10-12H2,1H3,(H,22,27)(H,24,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18085 (2-({[2-(benzyloxy)phenyl]methyl}amino)-1-(3-chloro...) Show SMILES OC(CNCc1ccccc1OCc1ccccc1)c1cccc(Cl)c1 Show InChI InChI=1S/C22H22ClNO2/c23-20-11-6-10-18(13-20)21(25)15-24-14-19-9-4-5-12-22(19)26-16-17-7-2-1-3-8-17/h1-13,21,24-25H,14-16H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18105 (2-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES CCNC(=O)COc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C17H21BrN2O3S/c1-2-20-17(22)10-23-15-6-4-3-5-12(15)8-19-9-14(21)16-7-13(18)11-24-16/h3-7,11,14,19,21H,2,8-10H2,1H3,(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18086 (2-({[2-(benzyloxy)phenyl]methyl}amino)-1-(3-iodoph...) Show SMILES OC(CNCc1ccccc1OCc1ccccc1)c1cccc(I)c1 Show InChI InChI=1S/C22H22INO2/c23-20-11-6-10-18(13-20)21(25)15-24-14-19-9-4-5-12-22(19)26-16-17-7-2-1-3-8-17/h1-13,21,24-25H,14-16H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18091 (1-(4-bromothiophen-2-yl)-2-({[2-(methoxymethoxy)ph...) Show SMILES COCOc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C15H18BrNO3S/c1-19-10-20-14-5-3-2-4-11(14)7-17-8-13(18)15-6-12(16)9-21-15/h2-6,9,13,17-18H,7-8,10H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18109 (3-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES CNC(=O)CNC(=O)CCOc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C19H24BrN3O4S/c1-21-19(26)11-23-18(25)6-7-27-16-5-3-2-4-13(16)9-22-10-15(24)17-8-14(20)12-28-17/h2-5,8,12,15,22,24H,6-7,9-11H2,1H3,(H,21,26)(H,23,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18104 (2-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES NC(=O)COc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C15H17BrN2O3S/c16-11-5-14(22-9-11)12(19)7-18-6-10-3-1-2-4-13(10)21-8-15(17)20/h1-5,9,12,18-19H,6-8H2,(H2,17,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18100 (1-(4-bromothiophen-2-yl)-2-({[2-(pyridin-2-ylmetho...) Show SMILES OC(CNCc1ccccc1OCc1ccccn1)c1cc(Br)cs1 Show InChI InChI=1S/C19H19BrN2O2S/c20-15-9-19(25-13-15)17(23)11-21-10-14-5-1-2-7-18(14)24-12-16-6-3-4-8-22-16/h1-9,13,17,21,23H,10-12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18111 (4-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES OC(CNCc1ccccc1OCCCC(O)=O)c1cc(Br)cs1 Show InChI InChI=1S/C17H20BrNO4S/c18-13-8-16(24-11-13)14(20)10-19-9-12-4-1-2-5-15(12)23-7-3-6-17(21)22/h1-2,4-5,8,11,14,19-20H,3,6-7,9-10H2,(H,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18092 (2-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES OC(CNCc1ccccc1OCC#N)c1cc(Br)cs1 Show InChI InChI=1S/C15H15BrN2O2S/c16-12-7-15(21-10-12)13(19)9-18-8-11-3-1-2-4-14(11)20-6-5-17/h1-4,7,10,13,18-19H,6,8-9H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18089 (1-(4-bromothiophen-2-yl)-2-{[(2-methoxyphenyl)meth...) Show SMILES COc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C14H16BrNO2S/c1-18-13-5-3-2-4-10(13)7-16-8-12(17)14-6-11(15)9-19-14/h2-6,9,12,16-17H,7-8H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18081 (2-({[2-(benzyloxy)phenyl]methyl}amino)-1-[3-(trifl...) Show SMILES OC(CNCc1ccccc1OCc1ccccc1)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C23H22F3NO2/c24-23(25,26)20-11-6-10-18(13-20)21(28)15-27-14-19-9-4-5-12-22(19)29-16-17-7-2-1-3-8-17/h1-13,21,27-28H,14-16H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Haemophilus influenzae)	BDBM18116 (2-[2-({[(2R)-2-(4-bromothiophen-2-yl)-2-hydroxyeth...) Show SMILES OCCOc1ccccc1CNC[C@@H](O)c1cc(Br)cs1 |r| Show InChI InChI=1S/C15H18BrNO3S/c16-12-7-15(21-10-12)13(19)9-17-8-11-3-1-2-4-14(11)20-6-5-18/h1-4,7,10,13,17-19H,5-6,8-9H2/t13-/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	56	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18080 (2-({[2-(prop-2-en-1-yloxy)phenyl]methyl}amino)-1-[...) Show SMILES OC(CNCc1ccccc1OCC=C)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C19H20F3NO2/c1-2-10-25-18-9-4-3-6-15(18)12-23-13-17(24)14-7-5-8-16(11-14)19(20,21)22/h2-9,11,17,23-24H,1,10,12-13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	58	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18108 (3-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES OC(CNCc1ccccc1OCCC(O)=O)c1cc(Br)cs1 Show InChI InChI=1S/C16H18BrNO4S/c17-12-7-15(23-10-12)13(19)9-18-8-11-3-1-2-4-14(11)22-6-5-16(20)21/h1-4,7,10,13,18-19H,5-6,8-9H2,(H,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	58	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18115 (2-{4-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl...) Show SMILES OC(CNCc1ccccc1OCCCCN1C(=O)c2ccccc2C1=O)c1cc(Br)cs1 Show InChI InChI=1S/C25H25BrN2O4S/c26-18-13-23(33-16-18)21(29)15-27-14-17-7-1-4-10-22(17)32-12-6-5-11-28-24(30)19-8-2-3-9-20(19)25(28)31/h1-4,7-10,13,16,21,27,29H,5-6,11-12,14-15H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	69	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18087 (2-({[2-(benzyloxy)phenyl]methyl}amino)-1-(3-methox...) Show SMILES COc1cccc(c1)C(O)CNCc1ccccc1OCc1ccccc1 Show InChI InChI=1S/C23H25NO3/c1-26-21-12-7-11-19(14-21)22(25)16-24-15-20-10-5-6-13-23(20)27-17-18-8-3-2-4-9-18/h2-14,22,24-25H,15-17H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18077 (2-[({2-hydroxy-2-[3-(trifluoromethyl)phenyl]ethyl}...) Show SMILES OC(CNCc1ccccc1O)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C16H16F3NO2/c17-16(18,19)13-6-3-5-11(8-13)15(22)10-20-9-12-4-1-2-7-14(12)21/h1-8,15,20-22H,9-10H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI (Staphylococcus aureus)	BDBM8767 (1,2,3,4-Tetrahydropyrido[3,4-b]indole 3 | 4-({9-[(...) Show SMILES Oc1ccc(Cn2c3CN(CCc3c3ccccc23)C(=O)c2ccc(O)cc2)cc1 Show InChI InChI=1S/C25H22N2O3/c28-19-9-5-17(6-10-19)15-27-23-4-2-1-3-21(23)22-13-14-26(16-24(22)27)25(30)18-7-11-20(29)12-8-18/h1-12,28-29H,13-16H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	DrugBank PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	6.5	30
GlaxoSmithKline					Assay Description Assays were carried out in half-area, 96-well microtiter plates. Compounds were evaluated in assay mixtures containing components specific for each e...				Bioorg Med Chem Lett 11: 2241-4 (2001) Article DOI: 10.1016/s0960-894x(01)00405-x BindingDB Entry DOI: 10.7270/Q24X5610
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18082 (1-(3-bromophenyl)-2-{[(2-methoxyphenyl)methyl]amin...) Show SMILES COc1ccccc1CNCC(O)c1cccc(Br)c1 Show InChI InChI=1S/C16H18BrNO2/c1-20-16-8-3-2-5-13(16)10-18-11-15(19)12-6-4-7-14(17)9-12/h2-9,15,18-19H,10-11H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18107 (2-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES CN(CCO)C(=O)COc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C18H23BrN2O4S/c1-21(6-7-22)18(24)11-25-16-5-3-2-4-13(16)9-20-10-15(23)17-8-14(19)12-26-17/h2-5,8,12,15,20,22-23H,6-7,9-11H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18083 (2-{[(2-methoxyphenyl)methyl]amino}-1-(3-methylphen...) Show SMILES COc1ccccc1CNCC(O)c1cccc(C)c1 Show InChI InChI=1S/C17H21NO2/c1-13-6-5-8-14(10-13)16(19)12-18-11-15-7-3-4-9-17(15)20-2/h3-10,16,18-19H,11-12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI (Staphylococcus aureus)	BDBM8786 (1,2,3,4-tetrahydro pyrido[3,4-b]indole 30 | 2-({9-...) Show SMILES Cc1ccc(C(=O)N2CCc3c(C2)n(Cc2ccc(O)cc2)c2ccccc32)c(O)c1 Show InChI InChI=1S/C26H24N2O3/c1-17-6-11-22(25(30)14-17)26(31)27-13-12-21-20-4-2-3-5-23(20)28(24(21)16-27)15-18-7-9-19(29)10-8-18/h2-11,14,29-30H,12-13,15-16H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	30
GlaxoSmithKline					Assay Description Assays were carried out in half-area, 96-well microtiter plates. Compounds were evaluated in assay mixtures containing components specific for each e...				Bioorg Med Chem Lett 11: 2241-4 (2001) Article DOI: 10.1016/s0960-894x(01)00405-x BindingDB Entry DOI: 10.7270/Q24X5610
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18090 (1-(4-bromothiophen-2-yl)-2-{[(2-phenoxyphenyl)meth...) Show SMILES OC(CNCc1ccccc1Oc1ccccc1)c1cc(Br)cs1 Show InChI InChI=1S/C19H18BrNO2S/c20-15-10-19(24-13-15)17(22)12-21-11-14-6-4-5-9-18(14)23-16-7-2-1-3-8-16/h1-10,13,17,21-22H,11-12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18106 (2-[2-({[2-(4-bromothiophen-2-yl)-2-hydroxyethyl]am...) Show SMILES CNC(=O)CNC(=O)COc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C18H22BrN3O4S/c1-20-17(24)9-22-18(25)10-26-15-5-3-2-4-12(15)7-21-8-14(23)16-6-13(19)11-27-16/h2-6,11,14,21,23H,7-10H2,1H3,(H,20,24)(H,22,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Haemophilus influenzae)	BDBM18103 (2-({[2-(1H-1,3-benzodiazol-2-ylmethoxy)phenyl]meth...) Show SMILES OC(CNCc1ccccc1OCc1nc2ccccc2[nH]1)c1cc(Br)cs1 Show InChI InChI=1S/C21H20BrN3O2S/c22-15-9-20(28-13-15)18(26)11-23-10-14-5-1-4-8-19(14)27-12-21-24-16-6-2-3-7-17(16)25-21/h1-9,13,18,23,26H,10-12H2,(H,24,25)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI (Staphylococcus aureus)	BDBM8789 (1,2,3,4-tetrahydro pyrido[3,4-b]indole 33 | 2-chlo...) Show SMILES Oc1ccc(Cn2c3CN(CCc3c3ccccc23)C(=O)c2ccc(O)c(Cl)c2)cc1 Show InChI InChI=1S/C25H21ClN2O3/c26-21-13-17(7-10-24(21)30)25(31)27-12-11-20-19-3-1-2-4-22(19)28(23(20)15-27)14-16-5-8-18(29)9-6-16/h1-10,13,29-30H,11-12,14-15H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	30
GlaxoSmithKline					Assay Description Assays were carried out in half-area, 96-well microtiter plates. Compounds were evaluated in assay mixtures containing components specific for each e...				Bioorg Med Chem Lett 11: 2241-4 (2001) Article DOI: 10.1016/s0960-894x(01)00405-x BindingDB Entry DOI: 10.7270/Q24X5610
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI (Staphylococcus aureus)	BDBM8787 (1,2,3,4-tetrahydro pyrido[3,4-b]indole 31 | 5-chlo...) Show SMILES Oc1ccc(Cn2c3CN(CCc3c3ccccc23)C(=O)c2ccc(Cl)cc2O)cc1 Show InChI InChI=1S/C25H21ClN2O3/c26-17-7-10-21(24(30)13-17)25(31)27-12-11-20-19-3-1-2-4-22(19)28(23(20)15-27)14-16-5-8-18(29)9-6-16/h1-10,13,29-30H,11-12,14-15H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	30
GlaxoSmithKline					Assay Description Assays were carried out in half-area, 96-well microtiter plates. Compounds were evaluated in assay mixtures containing components specific for each e...				Bioorg Med Chem Lett 11: 2241-4 (2001) Article DOI: 10.1016/s0960-894x(01)00405-x BindingDB Entry DOI: 10.7270/Q24X5610
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18079 (2-{[(2-methoxyphenyl)methyl]amino}-1-[3-(trifluoro...) Show SMILES COc1ccccc1CNCC(O)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C17H18F3NO2/c1-23-16-8-3-2-5-13(16)10-21-11-15(22)12-6-4-7-14(9-12)17(18,19)20/h2-9,15,21-22H,10-11H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18072 (2-(benzylamino)-1-[3-(trifluoromethyl)phenyl]ethan...) Show SMILES OC(CNCc1ccccc1)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C16H16F3NO/c17-16(18,19)14-8-4-7-13(9-14)15(21)11-20-10-12-5-2-1-3-6-12/h1-9,15,20-21H,10-11H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI (Staphylococcus aureus)	BDBM8778 (1,2,3,4-tetrahydro pyrido[3,4-b]indole 22 | 4-({2-...) Show SMILES Oc1ccc(Cn2c3CN(CCc3c3ccccc23)C(=O)c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C25H21ClN2O2/c26-19-9-7-18(8-10-19)25(30)27-14-13-22-21-3-1-2-4-23(21)28(24(22)16-27)15-17-5-11-20(29)12-6-17/h1-12,29H,13-16H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	30
GlaxoSmithKline					Assay Description Assays were carried out in half-area, 96-well microtiter plates. Compounds were evaluated in assay mixtures containing components specific for each e...				Bioorg Med Chem Lett 11: 2241-4 (2001) Article DOI: 10.1016/s0960-894x(01)00405-x BindingDB Entry DOI: 10.7270/Q24X5610
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI (Staphylococcus aureus)	BDBM8788 (1,2,3,4-tetrahydro pyrido[3,4-b]indole 32 | 4-({9-...) Show SMILES Cc1cc(ccc1O)C(=O)N1CCc2c(C1)n(Cc1ccc(O)cc1)c1ccccc21 Show InChI InChI=1S/C26H24N2O3/c1-17-14-19(8-11-25(17)30)26(31)27-13-12-22-21-4-2-3-5-23(21)28(24(22)16-27)15-18-6-9-20(29)10-7-18/h2-11,14,29-30H,12-13,15-16H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	30
GlaxoSmithKline					Assay Description Assays were carried out in half-area, 96-well microtiter plates. Compounds were evaluated in assay mixtures containing components specific for each e...				Bioorg Med Chem Lett 11: 2241-4 (2001) Article DOI: 10.1016/s0960-894x(01)00405-x BindingDB Entry DOI: 10.7270/Q24X5610
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18084 (2-{[(2-methoxyphenyl)methyl]amino}-1-[3-(trifluoro...) Show SMILES COc1ccccc1CNCC(O)c1cccc(OC(F)(F)F)c1 Show InChI InChI=1S/C17H18F3NO3/c1-23-16-8-3-2-5-13(16)10-21-11-15(22)12-6-4-7-14(9-12)24-17(18,19)20/h2-9,15,21-22H,10-11H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Streptococcus pneumoniae)	BDBM18116 (2-[2-({[(2R)-2-(4-bromothiophen-2-yl)-2-hydroxyeth...) Show SMILES OCCOc1ccccc1CNC[C@@H](O)c1cc(Br)cs1 |r| Show InChI InChI=1S/C15H18BrNO3S/c16-12-7-15(21-10-12)13(19)9-17-8-11-3-1-2-4-14(11)20-6-5-18/h1-4,7,10,13,17-19H,5-6,8-9H2/t13-/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	2.0	n/a
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Phenylalanine--tRNA ligase alpha/beta subunit (Staphylococcus aureus)	BDBM18094 (2-({[2-(2-aminoethoxy)phenyl]methyl}amino)-1-(4-br...) Show SMILES NCCOc1ccccc1CNCC(O)c1cc(Br)cs1 Show InChI InChI=1S/C15H19BrN2O2S/c16-12-7-15(21-10-12)13(19)9-18-8-11-3-1-2-4-14(11)20-6-5-17/h1-4,7,10,13,18-19H,5-6,8-9,17H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	7.9	37
GSK					Assay Description The reactions were performed in 96-well Packard 384-well Packard Optiplates. After 10 min of incubation, the reaction was stopped by addition of a co...				Bioorg Med Chem Lett 15: 2305-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.003 BindingDB Entry DOI: 10.7270/Q25D8Q3C
					More data for this Ligand-Target Pair
Enoyl-[acyl-carrier-protein] reductase [NADPH] FabI (Staphylococcus aureus)	BDBM8776 (1,2,3,4-tetrahydro pyrido[3,4-b]indole 20 | 4-({2-...) Show SMILES Cc1ccc(cc1)C(=O)N1CCc2c(C1)n(Cc1ccc(O)cc1)c1ccccc21 Show InChI InChI=1S/C26H24N2O2/c1-18-6-10-20(11-7-18)26(30)27-15-14-23-22-4-2-3-5-24(22)28(25(23)17-27)16-19-8-12-21(29)13-9-19/h2-13,29H,14-17H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	30
GlaxoSmithKline					Assay Description Assays were carried out in half-area, 96-well microtiter plates. Compounds were evaluated in assay mixtures containing components specific for each e...				Bioorg Med Chem Lett 11: 2241-4 (2001) Article DOI: 10.1016/s0960-894x(01)00405-x BindingDB Entry DOI: 10.7270/Q24X5610
					More data for this Ligand-Target Pair

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