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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sporulation kinase A' and Ligand = 'BDBM50218653'   
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
Sporulation kinase A


(Bacillus subtilis (strain 168))		BDBM50218653
PNG
(CHEMBL39178)
Show SMILES CC(C)(C)c1cc(cc(c1)C(C)(C)C)-c1nc2cc(ccc2[nH]1)C(N)=N
Show InChI InChI=1S/C22H28N4/c1-21(2,3)15-9-14(10-16(12-15)22(4,5)6)20-25-17-8-7-13(19(23)24)11-18(17)26-20/h7-12H,1-6H3,(H3,23,24)(H,25,26)
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PubMed
n/an/a 2.50E+4n/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of KinA/Sp0F system two component (TCS) from Bacillus subtilis.

Bioorg Med Chem Lett 11: 1545-8 (2001)


BindingDB Entry DOI: 10.7270/Q2V69MSM
More data for this
Ligand-Target Pair