Found 2 hits in this display 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 |
1D-myo-inositol 2-acetamido-2-deoxy-alpha-D-glucopyranoside deacetylase
(Mycobacterium tuberculosis) | BDBM50227093
(CHEMBL238782 | N-((2R,3R,4R,5S,6R)-2-(cyclohexylth...)Show SMILES OC[C@@H]1O[C@@H](SC2CCCCC2)[C@@H](NS(=O)(=O)CCCCc2ccccc2)[C@H](O)[C@H]1O Show InChI InChI=1S/C22H35NO6S2/c24-15-18-20(25)21(26)19(22(29-18)30-17-12-5-2-6-13-17)23-31(27,28)14-8-7-11-16-9-3-1-4-10-16/h1,3-4,9-10,17-26H,2,5-8,11-15H2/t18-,19-,20-,21-,22-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.01E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Diabetes and Digestive and Kidney Diseases
Curated by ChEMBL
| Assay Description Inhibition of Mycobacterium tuberculosis MshB by fluorescence-detected HPLC assay |
J Med Chem 50: 6326-36 (2007)
Article DOI: 10.1021/jm070669h BindingDB Entry DOI: 10.7270/Q21J99H9 |
More data for this Ligand-Target Pair | |
Mycothiol S-conjugate amidase
(Mycobacterium tuberculosis) | BDBM50227093
(CHEMBL238782 | N-((2R,3R,4R,5S,6R)-2-(cyclohexylth...)Show SMILES OC[C@@H]1O[C@@H](SC2CCCCC2)[C@@H](NS(=O)(=O)CCCCc2ccccc2)[C@H](O)[C@H]1O Show InChI InChI=1S/C22H35NO6S2/c24-15-18-20(25)21(26)19(22(29-18)30-17-12-5-2-6-13-17)23-31(27,28)14-8-7-11-16-9-3-1-4-10-16/h1,3-4,9-10,17-26H,2,5-8,11-15H2/t18-,19-,20-,21-,22-/m0/s1 | Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Diabetes and Digestive and Kidney Diseases
Curated by ChEMBL
| Assay Description Inhibition of Mycobacterium tuberculosis MCA by fluorescence-detected HPLC assay |
J Med Chem 50: 6326-36 (2007)
Article DOI: 10.1021/jm070669h BindingDB Entry DOI: 10.7270/Q21J99H9 |
More data for this Ligand-Target Pair | |