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SMILES: CCCCOCCOCCOCC(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12

InChI Key:

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50565080   

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...)	BDBM50565080 (CHEMBL4783410) Show SMILES CCCCOCCOCCOCC(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+5	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...)	BDBM50565080 (CHEMBL4783410) Show SMILES CCCCOCCOCCOCC(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r| Show InChI	MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+5	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