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Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase PknA' and Ligand = 'BDBM50279751'   
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
Serine/threonine-protein kinase PknA


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)		BDBM50279751
PNG
(CHEMBL4162719)
Show SMILES NS(=O)(=O)c1ccc(cc1)-c1nc(Nc2cc([nH]n2)C2CC2)c2cc(Cl)ccc2n1
Show InChI InChI=1S/C20H17ClN6O2S/c21-13-5-8-16-15(9-13)20(24-18-10-17(26-27-18)11-1-2-11)25-19(23-16)12-3-6-14(7-4-12)30(22,28)29/h3-11H,1-2H2,(H2,22,28,29)(H2,23,24,25,26,27)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
 22n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals Inc

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis PknA (M1 to A296 residues) expressed in Escherichia coli BL21 (DE3) pLysS cells using [T-33P]ATP as substrat...

ACS Med Chem Lett 8: 1224-1229 (2017)


Article DOI: 10.1021/acsmedchemlett.7b00239
BindingDB Entry DOI: 10.7270/Q2183910
More data for this
Ligand-Target Pair