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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50497759   
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...)		BDBM50497759
PNG
(CHEMBL3309661)
Show SMILES Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccccc1
Show InChI InChI=1S/C16H14N4O2/c1-11-14(20-10-6-5-9-13(20)17-11)16(22)19-18-15(21)12-7-3-2-4-8-12/h2-10H,1H3,(H,18,21)(H,19,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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DrugBank
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.54E+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