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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM50039492 (CHEMBL1231498) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL DrugBank PC cid PC sid PDB UniChem Patents Similars | DrugBank PDB Article PubMed | 87 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Adelaide Curated by ChEMBL | Assay Description Inhibition of Escherichia coli recombinant BPL using 3H-biotin as substrate after 10 mins by liquid scintillation counting analysis | ACS Med Chem Lett 6: 216-20 (2015) Article DOI: 10.1021/ml500475n BindingDB Entry DOI: 10.7270/Q2VT1TTQ | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM161472 (US9108978, 2.02) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | US Patent | 225 | -39.5 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
Monash University; Adelaide Research & Innovation Pty Ltd US Patent | Assay Description Quantitation of BPL catalysed 3H-biotin incorporation into the biotin domain substrate was performed as previously described by Polyak et al, J. Biol... | US Patent US9108978 (2015) BindingDB Entry DOI: 10.7270/Q2T43RVW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM161472 (US9108978, 2.02) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | US Patent | 420 | -37.9 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
Monash University; Adelaide Research & Innovation Pty Ltd US Patent | Assay Description Quantitation of BPL catalysed 3H-biotin incorporation into the biotin domain substrate was performed as previously described by Polyak et al, J. Biol... | US Patent US9108978 (2015) BindingDB Entry DOI: 10.7270/Q2T43RVW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM161468 (US9108978, 6.09) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid PDB UniChem Similars | US Patent | >3.00E+4 | >-26.9 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
Monash University; Adelaide Research & Innovation Pty Ltd US Patent | Assay Description Quantitation of BPL catalysed 3H-biotin incorporation into the biotin domain substrate was performed as previously described by Polyak et al, J. Biol... | US Patent US9108978 (2015) BindingDB Entry DOI: 10.7270/Q2T43RVW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM161467 (US9108978, 3.25) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | >3.00E+4 | >-26.9 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
Monash University; Adelaide Research & Innovation Pty Ltd US Patent | Assay Description Quantitation of BPL catalysed 3H-biotin incorporation into the biotin domain substrate was performed as previously described by Polyak et al, J. Biol... | US Patent US9108978 (2015) BindingDB Entry DOI: 10.7270/Q2T43RVW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM161467 (US9108978, 3.25) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | >3.00E+4 | >-26.9 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
Monash University; Adelaide Research & Innovation Pty Ltd US Patent | Assay Description Quantitation of BPL catalysed 3H-biotin incorporation into the biotin domain substrate was performed as previously described by Polyak et al, J. Biol... | US Patent US9108978 (2015) BindingDB Entry DOI: 10.7270/Q2T43RVW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM161470 (US9108978, 4.01) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid PDB UniChem | US Patent | >3.00E+4 | >-26.9 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
Monash University; Adelaide Research & Innovation Pty Ltd US Patent | Assay Description Quantitation of BPL catalysed 3H-biotin incorporation into the biotin domain substrate was performed as previously described by Polyak et al, J. Biol... | US Patent US9108978 (2015) BindingDB Entry DOI: 10.7270/Q2T43RVW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM161469 (US9108978, 6.07) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | US Patent | >3.00E+4 | >-26.9 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
Monash University; Adelaide Research & Innovation Pty Ltd US Patent | Assay Description Quantitation of BPL catalysed 3H-biotin incorporation into the biotin domain substrate was performed as previously described by Polyak et al, J. Biol... | US Patent US9108978 (2015) BindingDB Entry DOI: 10.7270/Q2T43RVW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM161469 (US9108978, 6.07) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | US Patent | >3.00E+4 | >-26.9 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
Monash University; Adelaide Research & Innovation Pty Ltd US Patent | Assay Description Quantitation of BPL catalysed 3H-biotin incorporation into the biotin domain substrate was performed as previously described by Polyak et al, J. Biol... | US Patent US9108978 (2015) BindingDB Entry DOI: 10.7270/Q2T43RVW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM161470 (US9108978, 4.01) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid PDB UniChem | US Patent | >3.00E+4 | >-26.9 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
Monash University; Adelaide Research & Innovation Pty Ltd US Patent | Assay Description Quantitation of BPL catalysed 3H-biotin incorporation into the biotin domain substrate was performed as previously described by Polyak et al, J. Biol... | US Patent US9108978 (2015) BindingDB Entry DOI: 10.7270/Q2T43RVW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM161468 (US9108978, 6.09) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid PDB UniChem Similars | US Patent | >3.00E+4 | >-26.9 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
Monash University; Adelaide Research & Innovation Pty Ltd US Patent | Assay Description Quantitation of BPL catalysed 3H-biotin incorporation into the biotin domain substrate was performed as previously described by Polyak et al, J. Biol... | US Patent US9108978 (2015) BindingDB Entry DOI: 10.7270/Q2T43RVW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119454 (CHEMBL3140272) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase CHEMBL MCE PC cid PC sid PDB UniChem Similars | PDB Article PubMed | n/a | n/a | n/a | 0.865 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119455 (CHEMBL3613838) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.592 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119456 (CHEMBL3613839) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.315 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50445153 (CHEMBL3103891) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Inhibition of biotin binding to Mycobacterium tuberculosis BirA by isothermal titration calorimetry | ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400328a BindingDB Entry DOI: 10.7270/Q2057HF1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50445154 (CHEMBL3103890) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.230 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Inhibition of biotin binding to Mycobacterium tuberculosis BirA by isothermal titration calorimetry | ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400328a BindingDB Entry DOI: 10.7270/Q2057HF1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50445155 (CHEMBL3103889) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.0400 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Inhibition of biotin binding to Mycobacterium tuberculosis BirA by isothermal titration calorimetry | ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400328a BindingDB Entry DOI: 10.7270/Q2057HF1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119453 (CHEMBL3613828) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.753 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119452 (CHEMBL3613829) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 2.10 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119447 (CHEMBL3613830) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.540 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119431 (CHEMBL3613831) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.933 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119427 (CHEMBL3613832) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.627 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119406 (CHEMBL3613833) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.0270 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119364 (CHEMBL3613834) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | 0.614 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50445156 (CHEMBL3103888) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.100 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Inhibition of biotin binding to Mycobacterium tuberculosis BirA by isothermal titration calorimetry | ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400328a BindingDB Entry DOI: 10.7270/Q2057HF1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119306 (CHEMBL3613836) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.769 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119305 (CHEMBL3613837) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.324 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Bifunctional ligase/repressor BirA (Escherichia coli) | BDBM50039492 (CHEMBL1231498) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL DrugBank PC cid PC sid PDB UniChem Patents Similars | DrugBank PDB Article PubMed | n/a | n/a | n/a | 1.5 | n/a | n/a | n/a | n/a | n/a |
University of Nebraska-Lincoln Curated by ChEMBL | Assay Description Binding affinity to Escherichia coli biotin protein ligase | Bioorg Med Chem Lett 24: 5568-71 (2014) Article DOI: 10.1016/j.bmcl.2014.11.010 BindingDB Entry DOI: 10.7270/Q2W097KM | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
Biotin--[biotin carboxyl-carrier protein] ligase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...) | BDBM50119307 (CHEMBL3613835) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | n/a | 0.153 | n/a | n/a | n/a | n/a | n/a |
University of Minnesota Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis H37Rv Biotin protein ligase expressed in Escherichia coli by ITC analysis | J Med Chem 58: 7349-69 (2015) Article DOI: 10.1021/acs.jmedchem.5b00719 BindingDB Entry DOI: 10.7270/Q21J9CMG | |||||||||||
More data for this Ligand-Target Pair |