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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 = 'BDBM50471720'   
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))		BDBM50471720
PNG
(CHEMBL319852)
Show SMILES Cc1cc(C(C#N)c2ccc(Cl)cc2)c(Cl)cc1NC(=O)c1cc(cc(c1O)C(C)(C)C)C(C)(C)C
Show InChI InChI=1S/C30H32Cl2N2O2/c1-17-12-21(23(16-33)18-8-10-20(31)11-9-18)25(32)15-26(17)34-28(36)22-13-19(29(2,3)4)14-24(27(22)35)30(5,6)7/h8-15,23,35H,1-7H3,(H,34,36)
PDB

UniProtKB/SwissProt

GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>5.00E+5n/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of the two-component signal transduction system kinase was measured using the KinA/Spo0F regulatory system of Bacil...

J Med Chem 41: 2939-45 (1998)


Article DOI: 10.1021/jm9803572
BindingDB Entry DOI: 10.7270/Q2VM4G0W
More data for this
Ligand-Target Pair