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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM50240433 (5-Isopropyl-2-methyl-phenol | CARVACROL | CHEMBL28...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 1.06E+3 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM248169 (Thymol derivative, 17) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase KEGG PC cid PC sid UniChem | Article PubMed | n/a | n/a | 4.08E+3 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM248165 (Carvacrol derivative, 8) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase KEGG PC cid PC sid PDB UniChem | Article PubMed | n/a | n/a | 1.16E+4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM248163 ((±)Neo isopulegol) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem | Article PubMed | n/a | n/a | 1.36E+4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM248168 (Carvacrol derivative, 15) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 1.37E+4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM248167 (Carvacrol derivative, 10) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 2.14E+4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM248170 (Thymol derivative, 21) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem | Article PubMed | n/a | n/a | 2.16E+4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM248166 (Carvacrol derivative, 9) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase MCE KEGG PC cid PC sid UniChem | Article PubMed | n/a | n/a | 2.31E+4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM50177405 (3-methoxy-4-hydroxybenzaldehyde | 4-hydroxy-3-meth...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 2.48E+4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM248162 (Menthol) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem | Article PubMed | n/a | n/a | 2.64E+4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM248164 (Carvacrol derivative, 7) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | Article PubMed | n/a | n/a | 2.68E+4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM50240432 (1-hydroxy-5-methyl-2-isopropylbenzene | 2-isopropy...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 2.84E+4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Secreted chorismate mutase (Mycobacterium tuberculosis H37Rv) | BDBM50164168 (1,3,4-Eugenol | 1-Hydroxy-2-methoxy-4-allylbenzene...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | 2.86E+4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Birla Institute of Technology & Science-Pilani | Assay Description Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-... | J Enzyme Inhib Med Chem 29: 547-54 (2014) Article DOI: 10.3109/14756366.2013.823958 BindingDB Entry DOI: 10.7270/Q2MW2G15 | |||||||||||
More data for this Ligand-Target Pair |