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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 = 'BDBM50218648'   
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))		BDBM50218648
PNG
(CHEMBL290098)
Show SMILES CC(C)(N)CNC(=O)c1ccc2[nH]c(nc2c1)-c1cc(cc(c1O)C(C)(C)C)C(C)(C)C
Show InChI InChI=1S/C26H36N4O2/c1-24(2,3)16-12-17(21(31)18(13-16)25(4,5)6)22-29-19-10-9-15(11-20(19)30-22)23(32)28-14-26(7,8)27/h9-13,31H,14,27H2,1-8H3,(H,28,32)(H,29,30)
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PubMed
n/an/a 1.00E+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