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Found 1 hit Enz. Inhib. hit(s) with Target = 'Pantothenate synthetase' and Ligand = 'BDBM50497755'   
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
Pantothenate synthetase


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)		BDBM50497755
PNG
(CHEMBL3310303)
Show SMILES COc1ccccc1C(=O)NNC(=O)c1c(C)nc2ccccn12
Show InChI InChI=1S/C17H16N4O3/c1-11-15(21-10-6-5-9-14(21)18-11)17(23)20-19-16(22)12-7-3-4-8-13(12)24-2/h3-10H,1-2H3,(H,19,22)(H,20,23)
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.21E+3n/an/an/an/an/an/a



Birla Institute of Technology & Science-Pilani

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis pantothenate synthetase expressed in Escherichia coli BL21 (DE3) by spectrophotometry

Bioorg Med Chem 22: 4223-32 (2014)


Article DOI: 10.1016/j.bmc.2014.05.038
BindingDB Entry DOI: 10.7270/Q2D79FDX
More data for this
Ligand-Target Pair