Compile Data Set for Download or QSAR

Found 46 hits with Last Name = 'thresher' and Initial = 'j'   

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
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491052 (CHEMBL2377693) Show SMILES C[C@H](O)[C@H](NC(=O)c1ccc(cc1)C#Cc1ccc(CN2CCOCC2)cc1)C(=O)NO |r| Show InChI InChI=1S/C24H27N3O5/c1-17(28)22(24(30)26-31)25-23(29)21-10-8-19(9-11-21)3-2-18-4-6-20(7-5-18)16-27-12-14-32-15-13-27/h4-11,17,22,28,31H,12-16H2,1H3,(H,25,29)(H,26,30)/t17-,22-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491048 (CHEMBL2377694) Show SMILES C[C@H](O)[C@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C19H18N2O4/c1-13(22)17(19(24)21-25)20-18(23)16-11-9-15(10-12-16)8-7-14-5-3-2-4-6-14/h2-6,9-13,17,22,25H,1H3,(H,20,23)(H,21,24)/t13-,17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491047 (CHEMBL2377569) Show SMILES OCCCNC(=O)C[C@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C22H23N3O5/c26-14-4-13-23-20(27)15-19(22(29)25-30)24-21(28)18-11-9-17(10-12-18)8-7-16-5-2-1-3-6-16/h1-3,5-6,9-12,19,26,30H,4,13-15H2,(H,23,27)(H,24,28)(H,25,29)/t19-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491056 (CHEMBL2377567) Show SMILES ONC(=O)[C@H](Cc1cnc[nH]1)NC(=O)c1ccc(cc1)C#Cc1ccccc1 |r| Show InChI InChI=1S/C21H18N4O3/c26-20(24-19(21(27)25-28)12-18-13-22-14-23-18)17-10-8-16(9-11-17)7-6-15-4-2-1-3-5-15/h1-5,8-11,13-14,19,28H,12H2,(H,22,23)(H,24,26)(H,25,27)/t19-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491046 (CHEMBL2377699) Show SMILES OC[C@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C18H16N2O4/c21-12-16(18(23)20-24)19-17(22)15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-11,16,21,24H,12H2,(H,19,22)(H,20,23)/t16-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491051 (CHEMBL2377703) Show SMILES CS(=O)(=O)C[C@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C19H18N2O5S/c1-27(25,26)13-17(19(23)21-24)20-18(22)16-11-9-15(10-12-16)8-7-14-5-3-2-4-6-14/h2-6,9-12,17,24H,13H2,1H3,(H,20,22)(H,21,23)/t17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491045 (CHEMBL2377702) Show SMILES CSC[C@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C19H18N2O3S/c1-25-13-17(19(23)21-24)20-18(22)16-11-9-15(10-12-16)8-7-14-5-3-2-4-6-14/h2-6,9-12,17,24H,13H2,1H3,(H,20,22)(H,21,23)/t17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491044 (CHEMBL2377704) Show SMILES ONC(=O)[C@@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C23H18N2O3/c26-22(24-21(23(27)25-28)19-9-5-2-6-10-19)20-15-13-18(14-16-20)12-11-17-7-3-1-4-8-17/h1-10,13-16,21,28H,(H,24,26)(H,25,27)/t21-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491050 (CHEMBL2377698) Show SMILES CC(C)C(NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO Show InChI InChI=1S/C20H20N2O3/c1-14(2)18(20(24)22-25)21-19(23)17-12-10-16(11-13-17)9-8-15-6-4-3-5-7-15/h3-7,10-14,18,25H,1-2H3,(H,21,23)(H,22,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491055 (CHEMBL2377570) Show SMILES COCCNC(=O)C[C@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C22H23N3O5/c1-30-14-13-23-20(26)15-19(22(28)25-29)24-21(27)18-11-9-17(10-12-18)8-7-16-5-3-2-4-6-16/h2-6,9-12,19,29H,13-15H2,1H3,(H,23,26)(H,24,27)(H,25,28)/t19-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.60	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491058 (CHEMBL2377690) Show SMILES ONC(=O)C1(CCS(=O)(=O)CC1)NC(=O)c1ccc(cc1)C#Cc1ccccc1 Show InChI InChI=1S/C21H20N2O5S/c24-19(22-21(20(25)23-26)12-14-29(27,28)15-13-21)18-10-8-17(9-11-18)7-6-16-4-2-1-3-5-16/h1-5,8-11,26H,12-15H2,(H,22,24)(H,23,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491043 (CHEMBL2377571) Show SMILES ONC(=O)[C@H](CC(=O)NCC#C)NC(=O)c1ccc(cc1)C#Cc1ccccc1 |r| Show InChI InChI=1S/C22H19N3O4/c1-2-14-23-20(26)15-19(22(28)25-29)24-21(27)18-12-10-17(11-13-18)9-8-16-6-4-3-5-7-16/h1,3-7,10-13,19,29H,14-15H2,(H,23,26)(H,24,27)(H,25,28)/t19-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491053 (CHEMBL2377568) Show SMILES NC(=O)C[C@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C19H17N3O4/c20-17(23)12-16(19(25)22-26)21-18(24)15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-11,16,26H,12H2,(H2,20,23)(H,21,24)(H,22,25)/t16-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491042 (CHEMBL2377688) Show SMILES ONC(=O)C1(CCOCC1)NC(=O)c1ccc(cc1)C#Cc1ccccc1 Show InChI InChI=1S/C21H20N2O4/c24-19(22-21(20(25)23-26)12-14-27-15-13-21)18-10-8-17(9-11-18)7-6-16-4-2-1-3-5-16/h1-5,8-11,26H,12-15H2,(H,22,24)(H,23,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491059 (CHEMBL2377566) Show SMILES ONC(=O)[C@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C23H18N2O3/c26-22(24-21(23(27)25-28)19-9-5-2-6-10-19)20-15-13-18(14-16-20)12-11-17-7-3-1-4-8-17/h1-10,13-16,21,28H,(H,24,26)(H,25,27)/t21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM92261 (CS251) Show SMILES NC[C@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO Show InChI InChI=1S/C18H17N3O3/c19-12-16(18(23)21-24)20-17(22)15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-11,16,24H,12,19H2,(H,20,22)(H,21,23)/t16-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491041 (CHEMBL2377696) Show SMILES CC(NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO Show InChI InChI=1S/C18H16N2O3/c1-13(17(21)20-23)19-18(22)16-11-9-15(10-12-16)8-7-14-5-3-2-4-6-14/h2-6,9-13,23H,1H3,(H,19,22)(H,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491040 (CHEMBL2377689) Show SMILES ONC(=O)C1(CCSCC1)NC(=O)c1ccc(cc1)C#Cc1ccccc1 Show InChI InChI=1S/C21H20N2O3S/c24-19(22-21(20(25)23-26)12-14-27-15-13-21)18-10-8-17(9-11-18)7-6-16-4-2-1-3-5-16/h1-5,8-11,26H,12-15H2,(H,22,24)(H,23,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491049 (CHEMBL2377573) Show SMILES ONC(=O)C1(CCCCC1)NC(=O)c1ccc(cc1)C#Cc1ccccc1 Show InChI InChI=1S/C22H22N2O3/c25-20(23-22(21(26)24-27)15-5-2-6-16-22)19-13-11-18(12-14-19)10-9-17-7-3-1-4-8-17/h1,3-4,7-8,11-14,27H,2,5-6,15-16H2,(H,23,25)(H,24,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	98	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491057 (CHEMBL2377691) Show SMILES ONC(=O)C1(CCNCC1)NC(=O)c1ccc(cc1)C#Cc1ccccc1 Show InChI InChI=1S/C21H21N3O3/c25-19(23-21(20(26)24-27)12-14-22-15-13-21)18-10-8-17(9-11-18)7-6-16-4-2-1-3-5-16/h1-5,8-11,22,27H,12-15H2,(H,23,25)(H,24,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	102	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491060 (CHEMBL2377695) Show SMILES ONC(=O)CNC(=O)c1ccc(cc1)C#Cc1ccccc1 Show InChI InChI=1S/C17H14N2O3/c20-16(19-22)12-18-17(21)15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-11,22H,12H2,(H,18,21)(H,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	148	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491039 (CHEMBL2377572) Show SMILES ONC(=O)C1(CCC1)NC(=O)c1ccc(cc1)C#Cc1ccccc1 Show InChI InChI=1S/C20H18N2O3/c23-18(21-20(13-4-14-20)19(24)22-25)17-11-9-16(10-12-17)8-7-15-5-2-1-3-6-15/h1-3,5-6,9-12,25H,4,13-14H2,(H,21,23)(H,22,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	178	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497643 (CHEMBL3356585) Show SMILES ONC(=O)C1(CSc2ccc(cc2)C#Cc2ccc(CN3CCOCC3)cc2)CCOCC1 Show InChI InChI=1S/C26H30N2O4S/c29-25(27-30)26(11-15-31-16-12-26)20-33-24-9-7-22(8-10-24)2-1-21-3-5-23(6-4-21)19-28-13-17-32-18-14-28/h3-10,30H,11-20H2,(H,27,29)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491038 (CHEMBL2377700) Show SMILES OC[C@@H](NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C18H16N2O4/c21-12-16(18(23)20-24)19-17(22)15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-11,16,21,24H,12H2,(H,19,22)(H,20,23)/t16-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	206	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491037 (CHEMBL2377697) Show SMILES CC(C)(NC(=O)c1ccc(cc1)C#Cc1ccccc1)C(=O)NO Show InChI InChI=1S/C19H18N2O3/c1-19(2,18(23)21-24)20-17(22)16-12-10-15(11-13-16)9-8-14-6-4-3-5-7-14/h3-7,10-13,24H,1-2H3,(H,20,22)(H,21,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	219	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50200120 (CHEMBL260091 | CHIR-090 | US10875832, Compound ChI...) Show SMILES C[C@@H](O)[C@H](NC(=O)c1ccc(cc1)C#Cc1ccc(CN2CCOCC2)cc1)C(=O)NO |r| Show InChI InChI=1S/C24H27N3O5/c1-17(28)22(24(30)26-31)25-23(29)21-10-8-19(9-11-21)3-2-18-4-6-20(7-5-18)16-27-12-14-32-15-13-27/h4-11,17,22,28,31H,12-16H2,1H3,(H,25,29)(H,26,30)/t17-,22+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair				3D Structure (crystal)
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497651 (CHEMBL3356584) Show SMILES ONC(=O)C1(COc2ccc(cc2)C#Cc2ccc(CN3CCN(CC(=O)N4CCOCC4)CC3)cc2)CCOCC1 Show InChI InChI=1S/C32H40N4O6/c37-30(36-17-21-41-22-18-36)24-35-15-13-34(14-16-35)23-28-5-3-26(4-6-28)1-2-27-7-9-29(10-8-27)42-25-32(31(38)33-39)11-19-40-20-12-32/h3-10,39H,11-25H2,(H,33,38)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497657 (CHEMBL3356583) Show SMILES ONC(=O)C1(COc2ccc(cc2)C#Cc2ccc(CN3CCN(CCn4ccnc4)CC3)cc2)CCOCC1 Show InChI InChI=1S/C31H37N5O4/c37-30(33-38)31(11-21-39-22-12-31)24-40-29-9-7-27(8-10-29)2-1-26-3-5-28(6-4-26)23-35-18-15-34(16-19-35)17-20-36-14-13-32-25-36/h3-10,13-14,25,38H,11-12,15-24H2,(H,33,37)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497652 (CHEMBL3356196) Show SMILES C[C@H]1CN(Cc2ccc(cc2)C#Cc2ccc(OCC3(CCOCC3)C(=O)NO)cc2)C[C@@H](C)O1 |r| Show InChI InChI=1S/C28H34N2O5/c1-21-17-30(18-22(2)35-21)19-25-7-5-23(6-8-25)3-4-24-9-11-26(12-10-24)34-20-28(27(31)29-32)13-15-33-16-14-28/h5-12,21-22,32H,13-20H2,1-2H3,(H,29,31)/t21-,22+	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497644 (CHEMBL3356195) Show SMILES ONC(=O)C1(COc2ccc(cc2)C#Cc2ccc(CN3CCN(CCN4CCOCC4)CC3)cc2)CCOCC1 Show InChI InChI=1S/C32H42N4O5/c37-31(33-38)32(11-21-39-22-12-32)26-41-30-9-7-28(8-10-30)2-1-27-3-5-29(6-4-27)25-36-17-15-34(16-18-36)13-14-35-19-23-40-24-20-35/h3-10,38H,11-26H2,(H,33,37)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497646 (CHEMBL3356193) Show SMILES CC(=O)N1CCN(Cc2ccc(cc2)C#Cc2ccc(OCC3(CCOCC3)C(=O)NO)cc2)CC1 Show InChI InChI=1S/C28H33N3O5/c1-22(32)31-16-14-30(15-17-31)20-25-6-4-23(5-7-25)2-3-24-8-10-26(11-9-24)36-21-28(27(33)29-34)12-18-35-19-13-28/h4-11,34H,12-21H2,1H3,(H,29,33)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497642 (CHEMBL3356586) Show SMILES ONC(=O)C1(C[S+]([O-])c2ccc(cc2)C#Cc2ccc(CN3CCOCC3)cc2)CCOCC1 Show InChI InChI=1S/C26H30N2O5S/c29-25(27-30)26(11-15-32-16-12-26)20-34(31)24-9-7-22(8-10-24)2-1-21-3-5-23(6-4-21)19-28-13-17-33-18-14-28/h3-10,30H,11-20H2,(H,27,29)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Escherichia coli)	BDBM50491054 (CHEMBL2377692) Show SMILES ONC(=O)C1(CCN(Cc2ccccc2)CC1)NC(=O)c1ccc(cc1)C#Cc1ccccc1 Show InChI InChI=1S/C28H27N3O3/c32-26(25-15-13-23(14-16-25)12-11-22-7-3-1-4-8-22)29-28(27(33)30-34)17-19-31(20-18-28)21-24-9-5-2-6-10-24/h1-10,13-16,34H,17-21H2,(H,29,32)(H,30,33)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.43E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Escherichia coli str. K-12 substr. MG1655 LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20...				Bioorg Med Chem Lett 23: 2362-7 (2013) Article DOI: 10.1016/j.bmcl.2013.02.055 BindingDB Entry DOI: 10.7270/Q2F76GGD
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497655 (CHEMBL3356187) Show SMILES ONC(=O)C1(COc2ccc(cc2)C#Cc2ccc(CN3CCOCC3)cc2)CCOCC1 Show InChI InChI=1S/C26H30N2O5/c29-25(27-30)26(11-15-31-16-12-26)20-33-24-9-7-22(8-10-24)2-1-21-3-5-23(6-4-21)19-28-13-17-32-18-14-28/h3-10,30H,11-20H2,(H,27,29)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497640 (CHEMBL3356197) Show SMILES CN(C)CC1CN(Cc2ccc(cc2)C#Cc2ccc(OCC3(CCOCC3)C(=O)NO)cc2)CCO1 Show InChI InChI=1S/C29H37N3O5/c1-31(2)20-27-21-32(15-18-36-27)19-25-7-5-23(6-8-25)3-4-24-9-11-26(12-10-24)37-22-29(28(33)30-34)13-16-35-17-14-29/h5-12,27,34H,13-22H2,1-2H3,(H,30,33)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497650 (CHEMBL3356582) Show SMILES CN1CCN(Cc2ccc(cc2)C#Cc2ccc(OCC3(CCOCC3)C(=O)NO)cc2)CC1 Show InChI InChI=1S/C27H33N3O4/c1-29-14-16-30(17-15-29)20-24-6-4-22(5-7-24)2-3-23-8-10-25(11-9-23)34-21-27(26(31)28-32)12-18-33-19-13-27/h4-11,32H,12-21H2,1H3,(H,28,31)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497654 (CHEMBL3356186) Show SMILES ONC(=O)C1(CSc2ccc(Oc3ccc(Cl)cc3)cc2)CCOCC1 Show InChI InChI=1S/C19H20ClNO4S/c20-14-1-3-15(4-2-14)25-16-5-7-17(8-6-16)26-13-19(18(22)21-23)9-11-24-12-10-19/h1-8,23H,9-13H2,(H,21,22)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	7.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497645 (CHEMBL3356194) Show SMILES CC(C)N1CCN(Cc2ccc(cc2)C#Cc2ccc(OCC3(CCOCC3)C(=O)NO)cc2)CC1 Show InChI InChI=1S/C29H37N3O4/c1-23(2)32-17-15-31(16-18-32)21-26-7-5-24(6-8-26)3-4-25-9-11-27(12-10-25)36-22-29(28(33)30-34)13-19-35-20-14-29/h5-12,23,34H,13-22H2,1-2H3,(H,30,33)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497638 (CHEMBL3356588) Show SMILES COC1CCC(COc2ccc(cc2)C#Cc2ccc(CN3CCOCC3)cc2)(CC1)C(=O)NO Show InChI InChI=1S/C28H34N2O5/c1-33-25-12-14-28(15-13-25,27(31)29-32)21-35-26-10-8-23(9-11-26)3-2-22-4-6-24(7-5-22)20-30-16-18-34-19-17-30/h4-11,25,32H,12-21H2,1H3,(H,29,31)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497649 (CHEMBL3356188) Show SMILES ONC(=O)C1(COc2ccc(cc2)-c2ccccc2)CCOCC1 Show InChI InChI=1S/C19H21NO4/c21-18(20-22)19(10-12-23-13-11-19)14-24-17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-9,22H,10-14H2,(H,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497656 (CHEMBL3356581) Show SMILES COc1ccc(CNCc2ccc(cc2)C#Cc2ccc(OCC3(CCOCC3)C(=O)NO)cc2)cc1 Show InChI InChI=1S/C30H32N2O5/c1-35-27-12-10-26(11-13-27)21-31-20-25-6-4-23(5-7-25)2-3-24-8-14-28(15-9-24)37-22-30(29(33)32-34)16-18-36-19-17-30/h4-15,31,34H,16-22H2,1H3,(H,32,33)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497639 (CHEMBL3356189) Show SMILES ONC(=O)C1(COc2ccc(OCc3ccccc3)cc2)CCOCC1 Show InChI InChI=1S/C20H23NO5/c22-19(21-23)20(10-12-24-13-11-20)15-26-18-8-6-17(7-9-18)25-14-16-4-2-1-3-5-16/h1-9,23H,10-15H2,(H,21,22)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497647 (CHEMBL3356191) Show SMILES ONC(=O)C1(COc2ccc(cc2)C#CC#Cc2ccccc2)CCOCC1 Show InChI InChI=1S/C23H21NO4/c25-22(24-26)23(14-16-27-17-15-23)18-28-21-12-10-20(11-13-21)9-5-4-8-19-6-2-1-3-7-19/h1-3,6-7,10-13,26H,14-18H2,(H,24,25)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497641 (CHEMBL3356587) Show SMILES ONC(=O)C1(COc2ccc(cc2)C#Cc2ccc(CN3CCOCC3)cc2)CCC(O)CC1 Show InChI InChI=1S/C27H32N2O5/c30-24-11-13-27(14-12-24,26(31)28-32)20-34-25-9-7-22(8-10-25)2-1-21-3-5-23(6-4-21)19-29-15-17-33-18-16-29/h3-10,24,30,32H,11-20H2,(H,28,31)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497648 (CHEMBL3356190) Show SMILES ONC(=O)C1(COc2ccc(Oc3ccccc3)cc2)CCOCC1 Show InChI InChI=1S/C19H21NO5/c21-18(20-22)19(10-12-23-13-11-19)14-24-15-6-8-17(9-7-15)25-16-4-2-1-3-5-16/h1-9,22H,10-14H2,(H,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Pseudomonas aeruginosa)	BDBM50497653 (CHEMBL3356192) Show SMILES CC(C)(O)C#CC#Cc1ccc(OCC2(CCOCC2)C(=O)NO)cc1 Show InChI InChI=1S/C20H23NO5/c1-19(2,23)10-4-3-5-16-6-8-17(9-7-16)26-15-20(18(22)21-24)11-13-25-14-12-20/h6-9,23-24H,11-15H2,1-2H3,(H,21,22)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.39E+5	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of Pseudomonas aeruginosa LpxC using UDP-3-O-(R-3-hydroxydecanoyl)-N-acetylglucosamine as substrate preincubated for 20 mins before substr...				ACS Med Chem Lett 5: 1213-8 (2014) Article DOI: 10.1021/ml500210x BindingDB Entry DOI: 10.7270/Q2F76GKR
					More data for this Ligand-Target Pair