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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50528096   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Decaprenylphosphoryl-beta-D-ribose oxidase


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)		BDBM50528096
PNG
(CHEMBL4443878)
Show SMILES CC1(NC(=O)N(CC(=O)c2ccccc2C(F)(F)F)C1=O)c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C19H16F3N3O5S/c1-18(11-6-8-12(9-7-11)31(23,29)30)16(27)25(17(28)24-18)10-15(26)13-4-2-3-5-14(13)19(20,21)22/h2-9H,10H2,1H3,(H,24,28)(H2,23,29,30)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 100n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis DprE1 expressed in Escherichia coli BL21(DE3) cells

J Med Chem 63: 5367-5386 (2020)


Article DOI: 10.1021/acs.jmedchem.0c00107
BindingDB Entry DOI: 10.7270/Q24M9817
More data for this
Ligand-Target Pair