BDBM349604 US10208000, Compound 46
SMILES: CN(c1ccc2ccccc2c1)S(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1
InChI Key: InChIKey=HSAXTPZNMSIOAI-UHFFFAOYSA-N
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 |
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N-acetyltransferase Eis (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM349604 (US10208000, Compound 46) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid PDB UniChem | PDB US Patent | n/a | n/a | 0.240 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kentucky Research Foundation US Patent | Assay Description To investigate the potential of these compounds as Eis inhibitors for use in combination with KAN, their biochemical (IC50 values against purified Ei... | US Patent US10208000 (2019) BindingDB Entry DOI: 10.7270/Q28S4S2Z | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |