null
SMILES: Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COS(=O)(=O)NC(=O)CCCCCCCCCCOc2ccc(cc2)C(F)(F)F)[C@@H](O)[C@H]1O
InChI Key:
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Long-chain-fatty-acid--AMP ligase FadD28 (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM50565092 (CHEMBL4796355) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 1.56E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA | Assay Description Inhibition of Mycobacterium tuberculosis H37Rv FAAL28 Spectra expressed in Escherichia coli BL21(DE3) cells assessed as cleavage of MEsG by spectrosc... | Citation and Details Article DOI: 10.1016/j.ejmech.2020.112408 BindingDB Entry DOI: 10.7270/Q2Z60SS6 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Medium/long-chain-fatty-acid--CoA/3-oxocholest-4-en-26-oate--CoA ligase (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM50565092 (CHEMBL4796355) | MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 3.44E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA | Assay Description Inhibition of Mycobacterium tuberculosis H37Rv FACL19 Spectra expressed in Escherichia coli BL21(DE3) cells assessed as cleavage of MEsG by spectrosc... | Citation and Details Article DOI: 10.1016/j.ejmech.2020.112408 BindingDB Entry DOI: 10.7270/Q2Z60SS6 | |||||||||||
More data for this Ligand-Target Pair |