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There are 1 purchasable compounds for target: Pantothenate kinase (PanK)

Wt: 468.4
BDBM188489
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 188489   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Pantothenate kinase (PanK)


(Mycobacterium tuberculosis ATCC 25618/H37Rv)
BDBM188489
PNG
(Triazole 1a)
Show SMILES CC(NC(=O)c1ccccc1C(F)(F)F)c1nnc(SCCOc2ccc(F)cc2)n1C
Show InChI InChI=1/C21H20F4N4O2S/c1-13(26-19(30)16-5-3-4-6-17(16)21(23,24)25)18-27-28-20(29(18)2)32-12-11-31-15-9-7-14(22)8-10-15/h3-10,13H,11-12H2,1-2H3,(H,26,30)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/a 5.50E+3n/an/an/an/an/an/a



Uppsala University



Assay Description
Briefly, MtPanK activity was measured in a pyruvate kinaselactate dehydrogenase-coupled assay where the reaction rate was determined by spectrophotom...


J Biol Chem 288: 18260-70 (2013)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Pantothenate kinase (PanK)


(Mycobacterium tuberculosis ATCC 25618/H37Rv)
BDBM188489
PNG
(Triazole 1a)
Show SMILES CC(NC(=O)c1ccccc1C(F)(F)F)c1nnc(SCCOc2ccc(F)cc2)n1C
Show InChI InChI=1/C21H20F4N4O2S/c1-13(26-19(30)16-5-3-4-6-17(16)21(23,24)25)18-27-28-20(29(18)2)32-12-11-31-15-9-7-14(22)8-10-15/h3-10,13H,11-12H2,1-2H3,(H,26,30)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/a 90n/an/an/an/an/an/a



Uppsala University



Assay Description
Briefly, MtPanK activity was measured in a pyruvate kinaselactate dehydrogenase-coupled assay where the reaction rate was determined by spectrophotom...


J Biol Chem 288: 18260-70 (2013)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)