Compile Data Set for Download or QSAR

Found 21 hits of ki data for polymerid = 50004491   

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
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316579 (2-(2-Oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C13H13N2O7PS/c16-13-9-3-1-2-8-11(5-4-10(15-13)12(8)9)24(20,21)14-6-7-22-23(17,18)19/h1-5,14H,6-7H2,(H,15,16)(H2,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316577 (4-(2-Oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C15H17N2O7PS/c18-15-11-5-3-4-10-13(7-6-12(17-15)14(10)11)26(22,23)16-8-1-2-9-24-25(19,20)21/h3-7,16H,1-2,8-9H2,(H,17,18)(H2,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316578 (3-(2-Oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C14H15N2O7PS/c17-14-10-4-1-3-9-12(6-5-11(16-14)13(9)10)25(21,22)15-7-2-8-23-24(18,19)20/h1,3-6,15H,2,7-8H2,(H,16,17)(H2,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316576 (1,1-difluoro-5-(2-oxo-1,2-dihydrobenzo[cd]indole-6...) Show SMILES OP(O)(=O)C(F)(F)CCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C16H17F2N2O6PS/c17-16(18,27(22,23)24)8-1-2-9-19-28(25,26)13-7-6-12-14-10(13)4-3-5-11(14)15(21)20-12/h3-7,19H,1-2,8-9H2,(H,20,21)(H2,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316580 (6-(2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCCCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C17H21N2O7PS/c20-17-13-7-5-6-12-15(9-8-14(19-17)16(12)13)28(24,25)18-10-3-1-2-4-11-26-27(21,22)23/h5-9,18H,1-4,10-11H2,(H,19,20)(H2,21,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316581 (5-(2-Oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C16H19N2O7PS/c19-16-12-6-4-5-11-14(8-7-13(18-16)15(11)12)27(23,24)17-9-2-1-3-10-25-26(20,21)22/h4-8,17H,1-3,9-10H2,(H,18,19)(H2,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316575 (CHEMBL1095229 | Ethyl2-(6-chloro-2,4,dioxo-1,2,3,4...) Show SMILES CCOC(=O)C(=O)Nc1c(Cl)[nH]c(=O)[nH]c1=O Show InChI InChI=1S/C8H8ClN3O5/c1-2-17-7(15)6(14)10-3-4(9)11-8(16)12-5(3)13/h2H2,1H3,(H,10,14)(H2,11,12,13,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316577 (4-(2-Oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C15H17N2O7PS/c18-15-11-5-3-4-10-13(7-6-12(17-15)14(10)11)26(22,23)16-8-1-2-9-24-25(19,20)21/h3-7,16H,1-2,8-9H2,(H,17,18)(H2,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.80E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-inhibitor complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316574 (2-(2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OC(=O)CNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C13H10N2O5S/c16-11(17)6-14-21(19,20)10-5-4-9-12-7(10)2-1-3-8(12)13(18)15-9/h1-5,14H,6H2,(H,15,18)(H,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.80E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate-inhibitor complex state after 30 mins by fluorescence assa...				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316574 (2-(2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OC(=O)CNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C13H10N2O5S/c16-11(17)6-14-21(19,20)10-5-4-9-12-7(10)2-1-3-8(12)13(18)15-9/h1-5,14H,6H2,(H,15,18)(H,16,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-inhibitor complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316578 (3-(2-Oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C14H15N2O7PS/c17-14-10-4-1-3-9-12(6-5-11(16-14)13(9)10)25(21,22)15-7-2-8-23-24(18,19)20/h1,3-6,15H,2,7-8H2,(H,16,17)(H2,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.90E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-inhibitor complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316579 (2-(2-Oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C13H13N2O7PS/c16-13-9-3-1-2-8-11(5-4-10(15-13)12(8)9)24(20,21)14-6-7-22-23(17,18)19/h1-5,14H,6-7H2,(H,15,16)(H2,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.25E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate-inhibitor complex state after 30 mins by fluorescence assa...				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316579 (2-(2-Oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C13H13N2O7PS/c16-13-9-3-1-2-8-11(5-4-10(15-13)12(8)9)24(20,21)14-6-7-22-23(17,18)19/h1-5,14H,6-7H2,(H,15,16)(H2,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.60E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-inhibitor complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316578 (3-(2-Oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C14H15N2O7PS/c17-14-10-4-1-3-9-12(6-5-11(16-14)13(9)10)25(21,22)15-7-2-8-23-24(18,19)20/h1,3-6,15H,2,7-8H2,(H,16,17)(H2,18,19,20)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.34E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate-inhibitor complex state after 30 mins by fluorescence assa...				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316576 (1,1-difluoro-5-(2-oxo-1,2-dihydrobenzo[cd]indole-6...) Show SMILES OP(O)(=O)C(F)(F)CCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C16H17F2N2O6PS/c17-16(18,27(22,23)24)8-1-2-9-19-28(25,26)13-7-6-12-14-10(13)4-3-5-11(14)15(21)20-12/h3-7,19H,1-2,8-9H2,(H,20,21)(H2,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	5.18E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate-inhibitor complex state after 30 mins by fluorescence assa...				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316581 (5-(2-Oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C16H19N2O7PS/c19-16-12-6-4-5-11-14(8-7-13(18-16)15(11)12)27(23,24)17-9-2-1-3-10-25-26(20,21)22/h4-8,17H,1-3,9-10H2,(H,18,19)(H2,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.63E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate-inhibitor complex state after 30 mins by fluorescence assa...				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316577 (4-(2-Oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C15H17N2O7PS/c18-15-11-5-3-4-10-13(7-6-12(17-15)14(10)11)26(22,23)16-8-1-2-9-24-25(19,20)21/h3-7,16H,1-2,8-9H2,(H,17,18)(H2,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.72E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate-inhibitor complex state after 30 mins by fluorescence assa...				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316580 (6-(2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonamido)...) Show SMILES OP(O)(=O)OCCCCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C17H21N2O7PS/c20-17-13-7-5-6-12-15(9-8-14(19-17)16(12)13)28(24,25)18-10-3-1-2-4-11-26-27(21,22)23/h5-9,18H,1-4,10-11H2,(H,19,20)(H2,21,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.23E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate-inhibitor complex state after 30 mins by fluorescence assa...				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316575 (CHEMBL1095229 | Ethyl2-(6-chloro-2,4,dioxo-1,2,3,4...) Show SMILES CCOC(=O)C(=O)Nc1c(Cl)[nH]c(=O)[nH]c1=O Show InChI InChI=1S/C8H8ClN3O5/c1-2-17-7(15)6(14)10-3-4(9)11-8(16)12-5(3)13/h2H2,1H3,(H,10,14)(H2,11,12,13,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	8.32E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-inhibitor complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316576 (1,1-difluoro-5-(2-oxo-1,2-dihydrobenzo[cd]indole-6...) Show SMILES OP(O)(=O)C(F)(F)CCCCNS(=O)(=O)c1ccc2NC(=O)c3cccc1c23 Show InChI InChI=1S/C16H17F2N2O6PS/c17-16(18,27(22,23)24)8-1-2-9-19-28(25,26)13-7-6-12-14-10(13)4-3-5-11(14)15(21)20-12/h3-7,19H,1-2,8-9H2,(H,20,21)(H2,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	8.32E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-inhibitor complex state after 30 mins by fluorescence assay				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
					More data for this Ligand-Target Pair
6,7-dimethyl-8-ribityllumazine synthase (Mycobacterium tuberculosis)	BDBM50316575 (CHEMBL1095229 | Ethyl2-(6-chloro-2,4,dioxo-1,2,3,4...) Show SMILES CCOC(=O)C(=O)Nc1c(Cl)[nH]c(=O)[nH]c1=O Show InChI InChI=1S/C8H8ClN3O5/c1-2-17-7(15)6(14)10-3-4(9)11-8(16)12-5(3)13/h2H2,1H3,(H,10,14)(H2,11,12,13,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis recombinant lumazine synthase at enzyme-substrate-inhibitor complex state after 30 mins by fluorescence assa...				Bioorg Med Chem 18: 3518-34 (2010) Article DOI: 10.1016/j.bmc.2010.03.072 BindingDB Entry DOI: 10.7270/Q29P31S5
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