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Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase PknA' and Ligand = 'BDBM50279735'   
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...)		BDBM50279735
PNG
(CHEMBL4173877)
Show SMILES Clc1ccc2nc(nc(Nc3cc([nH]n3)C3CC3)c2c1)-c1cccc(c1)C#N
Show InChI InChI=1S/C21H15ClN6/c22-15-6-7-17-16(9-15)21(25-19-10-18(27-28-19)13-4-5-13)26-20(24-17)14-3-1-2-12(8-14)11-23/h1-3,6-10,13H,4-5H2,(H2,24,25,26,27,28)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
>4.00E+3n/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