Compile Data Set for Download or QSAR

Found 35 hits Enz. Inhib. hit(s) with Target = 'Diacylglycerol acyltransferase/mycolyltransferase Ag85C' AND taxid = 83332   

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
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148588 (CHEMBL325304 | Heptyl-phosphonic acid monoethyl es...) Show SMILES CCCCCCCP(O)(=O)OCC Show InChI InChI=1S/C9H21O3P/c1-3-5-6-7-8-9-13(10,11)12-4-2/h3-9H2,1-2H3,(H,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148588 (CHEMBL325304 | Heptyl-phosphonic acid monoethyl es...) Show SMILES CCCCCCCP(O)(=O)OCC Show InChI InChI=1S/C9H21O3P/c1-3-5-6-7-8-9-13(10,11)12-4-2/h3-9H2,1-2H3,(H,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank 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 Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148590 ((1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-methyl et...) Show SMILES CCCCCCCP(=O)(OCC)OCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C18H26NO5P/c1-3-5-6-7-10-13-25(22,23-4-2)24-14-19-17(20)15-11-8-9-12-16(15)18(19)21/h8-9,11-12H,3-7,10,13-14H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148590 ((1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-methyl et...) Show SMILES CCCCCCCP(=O)(OCC)OCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C18H26NO5P/c1-3-5-6-7-10-13-25(22,23-4-2)24-14-19-17(20)15-11-8-9-12-16(15)18(19)21/h8-9,11-12H,3-7,10,13-14H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148587 (CHEMBL326268 | Heptyl-phosphonic acid mono-[2-(1,3...) Show SMILES CCCCCCCP(O)(=O)OCCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C17H24NO5P/c1-2-3-4-5-8-13-24(21,22)23-12-11-18-16(19)14-9-6-7-10-15(14)17(18)20/h6-7,9-10H,2-5,8,11-13H2,1H3,(H,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50195746 (CHEMBL227546 | ethyl 3-phenoxybenzyl butylphosphon...) Show SMILES CCCCP(=O)(OCC)OCc1ccccc1Oc1ccccc1 Show InChI InChI=1S/C19H25O4P/c1-3-5-15-24(20,21-4-2)22-16-17-11-9-10-14-19(17)23-18-12-7-6-8-13-18/h6-14H,3-5,15-16H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148586 (Butyl-phosphonic acid ethyl ester 3-phenoxy-benzyl...) Show SMILES CCCCP(=O)(OCC)OCc1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C19H25O4P/c1-3-5-14-24(20,21-4-2)22-16-17-10-9-13-19(15-17)23-18-11-7-6-8-12-18/h6-13,15H,3-5,14,16H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148593 (CHEMBL119521 | Hexyl-phosphonic acid monoethyl est...) Show SMILES CCCCCCP(O)(=O)OCC Show InChI InChI=1S/C8H19O3P/c1-3-5-6-7-8-12(9,10)11-4-2/h3-8H2,1-2H3,(H,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	3.56E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148593 (CHEMBL119521 | Hexyl-phosphonic acid monoethyl est...) Show SMILES CCCCCCP(O)(=O)OCC Show InChI InChI=1S/C8H19O3P/c1-3-5-6-7-8-12(9,10)11-4-2/h3-8H2,1-2H3,(H,9,10)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	3.56E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148585 (CHEMBL418868 | Hexyl-phosphonic acid mono-[2-(1,3-...) Show SMILES CCCCCCP(O)(=O)OCCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C16H22NO5P/c1-2-3-4-7-12-23(20,21)22-11-10-17-15(18)13-8-5-6-9-14(13)16(17)19/h5-6,8-9H,2-4,7,10-12H2,1H3,(H,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.39E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148594 ((1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-methyl et...) Show SMILES CCCCP(=O)(OCC)OCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C15H20NO5P/c1-3-5-10-22(19,20-4-2)21-11-16-14(17)12-8-6-7-9-13(12)15(16)18/h6-9H,3-5,10-11H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148594 ((1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-methyl et...) Show SMILES CCCCP(=O)(OCC)OCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C15H20NO5P/c1-3-5-10-22(19,20-4-2)21-11-16-14(17)12-8-6-7-9-13(12)15(16)18/h6-9H,3-5,10-11H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50195743 (CHEMBL427453 | ethyl 3-phenoxybenzyl nonylphosphon...) Show SMILES CCCCCCCCCP(=O)(OCC)OCc1ccccc1Oc1ccccc1 Show InChI InChI=1S/C24H35O4P/c1-3-5-6-7-8-9-15-20-29(25,26-4-2)27-21-22-16-13-14-19-24(22)28-23-17-11-10-12-18-23/h10-14,16-19H,3-9,15,20-21H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.48E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148583 (CHEMBL325149 | Nonyl-phosphonic acid ethyl ester 3...) Show SMILES CCCCCCCCCP(=O)(OCC)OCc1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C24H35O4P/c1-3-5-6-7-8-9-13-19-29(25,26-4-2)27-21-22-15-14-18-24(20-22)28-23-16-11-10-12-17-23/h10-12,14-18,20H,3-9,13,19,21H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.48E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50195748 (CHEMBL227405 | ethyl 3-phenoxybenzyl heptylphospho...) Show SMILES CCCCCCCP(=O)(OCC)OCc1ccccc1Oc1ccccc1 Show InChI InChI=1S/C22H31O4P/c1-3-5-6-7-13-18-27(23,24-4-2)25-19-20-14-11-12-17-22(20)26-21-15-9-8-10-16-21/h8-12,14-17H,3-7,13,18-19H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148596 (CHEMBL278017 | Heptyl-phosphonic acid ethyl ester ...) Show SMILES CCCCCCCP(=O)(OCC)OCc1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C22H31O4P/c1-3-5-6-7-11-17-27(23,24-4-2)25-19-20-13-12-16-22(18-20)26-21-14-9-8-10-15-21/h8-10,12-16,18H,3-7,11,17,19H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148582 (2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-ethylet...) Show SMILES CCCCCCCCCP(=O)(OCC)OCCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C21H32NO5P/c1-3-5-6-7-8-9-12-17-28(25,26-4-2)27-16-15-22-20(23)18-13-10-11-14-19(18)21(22)24/h10-11,13-14H,3-9,12,15-17H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.57E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148582 (2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-ethylet...) Show SMILES CCCCCCCCCP(=O)(OCC)OCCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C21H32NO5P/c1-3-5-6-7-8-9-12-17-28(25,26-4-2)27-16-15-22-20(23)18-13-10-11-14-19(18)21(22)24/h10-11,13-14H,3-9,12,15-17H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.57E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148597 ((1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-methyleth...) Show SMILES CCCCCCCCCCCCCCP(=O)(OCC)OCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C25H40NO5P/c1-3-5-6-7-8-9-10-11-12-13-14-17-20-32(29,30-4-2)31-21-26-24(27)22-18-15-16-19-23(22)25(26)28/h15-16,18-19H,3-14,17,20-21H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148597 ((1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-methyleth...) Show SMILES CCCCCCCCCCCCCCP(=O)(OCC)OCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C25H40NO5P/c1-3-5-6-7-8-9-10-11-12-13-14-17-20-32(29,30-4-2)31-21-26-24(27)22-18-15-16-19-23(22)25(26)28/h15-16,18-19H,3-14,17,20-21H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148584 (CHEMBL118790 | Hexyl-phosphonic acid ethyl ester 3...) Show SMILES CCCCCCP(=O)(OCC)OCc1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C21H29O4P/c1-3-5-6-10-16-26(22,23-4-2)24-18-19-12-11-15-21(17-19)25-20-13-8-7-9-14-20/h7-9,11-15,17H,3-6,10,16,18H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.26E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50195749 (CHEMBL223946 | ethyl 3-phenoxybenzyl hexylphosphon...) Show SMILES CCCCCCP(=O)(OCC)OCc1ccccc1Oc1ccccc1 Show InChI InChI=1S/C21H29O4P/c1-3-5-6-12-17-26(22,23-4-2)24-18-19-13-10-11-16-21(19)25-20-14-8-7-9-15-20/h7-11,13-16H,3-6,12,17-18H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.26E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148591 (2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-ethyl e...) Show SMILES CCCCP(=O)(OCC)OCCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C16H22NO5P/c1-3-5-12-23(20,21-4-2)22-11-10-17-15(18)13-8-6-7-9-14(13)16(17)19/h6-9H,3-5,10-12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.07E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148591 (2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-ethyl e...) Show SMILES CCCCP(=O)(OCC)OCCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C16H22NO5P/c1-3-5-12-23(20,21-4-2)22-11-10-17-15(18)13-8-6-7-9-14(13)16(17)19/h6-9H,3-5,10-12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.07E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148592 ((1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-methyl et...) Show SMILES CCCCCCCCCP(=O)(OCC)OCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C20H30NO5P/c1-3-5-6-7-8-9-12-15-27(24,25-4-2)26-16-21-19(22)17-13-10-11-14-18(17)20(21)23/h10-11,13-14H,3-9,12,15-16H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.71E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148592 ((1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-methyl et...) Show SMILES CCCCCCCCCP(=O)(OCC)OCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C20H30NO5P/c1-3-5-6-7-8-9-12-15-27(24,25-4-2)26-16-21-19(22)17-13-10-11-14-18(17)20(21)23/h10-11,13-14H,3-9,12,15-16H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.71E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50195744 (CHEMBL227845 | ethyl 3,4,5-trimethoxybenzyl hexylp...) Show SMILES CCCCCCP(=O)(OCC)OCc1cc(OC)c(OC)c(OC)c1 Show InChI InChI=1S/C18H31O6P/c1-6-8-9-10-11-25(19,23-7-2)24-14-15-12-16(20-3)18(22-5)17(13-15)21-4/h12-13H,6-11,14H2,1-5H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.02E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50195747 (CHEMBL390336 | ethyl hydrogen4-(phthalimido)butylp...) Show SMILES CCOP(O)(=O)CCCCN1C(=O)c2ccccc2C1=O Show InChI InChI=1S/C14H18NO5P/c1-2-20-21(18,19)10-6-5-9-15-13(16)11-7-3-4-8-12(11)14(15)17/h3-4,7-8H,2,5-6,9-10H2,1H3,(H,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50195742 (CHEMBL227517 | ethyl hydrogen 2-phenylethylphospho...) Show SMILES CCOP(O)(=O)CCc1ccccc1 Show InChI InChI=1S/C10H15O3P/c1-2-13-14(11,12)9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,11,12)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.25E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148589 (Butyl-phosphonic acid monoethyl ester | CHEMBL1182...) Show SMILES CCCCP(O)(=O)OCC Show InChI InChI=1S/C6H15O3P/c1-3-5-6-10(7,8)9-4-2/h3-6H2,1-2H3,(H,7,8)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.31E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148589 (Butyl-phosphonic acid monoethyl ester | CHEMBL1182...) Show SMILES CCCCP(O)(=O)OCC Show InChI InChI=1S/C6H15O3P/c1-3-5-6-10(7,8)9-4-2/h3-6H2,1-2H3,(H,7,8)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.31E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148595 (CHEMBL119480 | Nonyl-phosphonic acid monoethyl est...) Show SMILES CCCCCCCCCP(O)(=O)OCC Show InChI InChI=1S/C11H25O3P/c1-3-5-6-7-8-9-10-11-15(12,13)14-4-2/h3-11H2,1-2H3,(H,12,13)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.71E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148595 (CHEMBL119480 | Nonyl-phosphonic acid monoethyl est...) Show SMILES CCCCCCCCCP(O)(=O)OCC Show InChI InChI=1S/C11H25O3P/c1-3-5-6-7-8-9-10-11-15(12,13)14-4-2/h3-11H2,1-2H3,(H,12,13)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.71E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50148581 (CHEMBL119236 | Tetradecyl-phosphonic acid ethyl es...) Show SMILES CCCCCCCCCCCCCCP(=O)(OCC)OCc1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C29H45O4P/c1-3-5-6-7-8-9-10-11-12-13-14-18-24-34(30,31-4-2)32-26-27-20-19-23-29(25-27)33-28-21-16-15-17-22-28/h15-17,19-23,25H,3-14,18,24,26H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.62E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description In vitro concentration required to inhibit antigen 85C mycolyltransferase activity in Mycobaterium tuberculosis				Bioorg Med Chem Lett 14: 3559-62 (2004) Article DOI: 10.1016/j.bmcl.2004.04.052 BindingDB Entry DOI: 10.7270/Q2C828RQ
					More data for this Ligand-Target Pair
Diacylglycerol acyltransferase/mycolyltransferase Ag85C (Mycobacterium tuberculosis)	BDBM50195745 (CHEMBL387718 | ethyl 3-phenoxybenzyl tetradecylpho...) Show SMILES CCCCCCCCCCCCCCP(=O)(OCC)OCc1ccccc1Oc1ccccc1 Show InChI InChI=1S/C29H45O4P/c1-3-5-6-7-8-9-10-11-12-13-14-20-25-34(30,31-4-2)32-26-27-21-18-19-24-29(27)33-28-22-16-15-17-23-28/h15-19,21-24H,3-14,20,25-26H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.62E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Ljubljana Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant antigen 85C mycolyltransferase				Eur J Med Chem 42: 54-63 (2007) Article DOI: 10.1016/j.ejmech.2006.08.007 BindingDB Entry DOI: 10.7270/Q2F18ZB3
					More data for this Ligand-Target Pair