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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine protease SplB' and Ligand = 'BDBM50395602'   
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 protease SplB


(Staphylococcus aureus)		BDBM50395602
PNG
(CHEMBL2165302)
Show SMILES COc1ccc(OP(=O)(Oc2ccc(OC)cc2)C(CCC(N)=O)NC(=O)OCc2ccccc2)cc1
Show InChI InChI=1S/C26H29N2O8P/c1-32-20-8-12-22(13-9-20)35-37(31,36-23-14-10-21(33-2)11-15-23)25(17-16-24(27)29)28-26(30)34-18-19-6-4-3-5-7-19/h3-15,25H,16-18H2,1-2H3,(H2,27,29)(H,28,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
>2.00E+5n/an/an/an/an/an/an/an/a



Wroclaw University of Technology

Curated by ChEMBL


Assay Description
Inhibition of Staphylococcus aureus SplB using fluorogenic Ac-Tro-Glu-Leu-Gln-ACC as substrate by spectrofluorometry

Bioorg Med Chem Lett 22: 5574-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.011
BindingDB Entry DOI: 10.7270/Q28W3FDZ
More data for this
Ligand-Target Pair