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Compile Data Set for Download or QSAR

Found 1 hit of ec50 for monomerid = 50527100   
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
ATP-dependent Clp protease proteolytic subunit


(Staphylococcus aureus (strain NCTC 8325))		BDBM50527100
PNG
(CHEMBL4457363)
Show SMILES COc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(C)C)B(O)O)c(C)c1 |r|
Show InChI InChI=1S/C23H31BN2O5/c1-15(2)12-21(24(29)30)26-23(28)20(14-17-8-6-5-7-9-17)25-22(27)19-11-10-18(31-4)13-16(19)3/h5-11,13,15,20-21,29-30H,12,14H2,1-4H3,(H,25,27)(H,26,28)/t20-,21-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 1.48E+4n/an/an/an/a



Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of ClpP in methicillin-resistant Staphylococcus aureus ATCC 33591 assessed as reduction in bacteria-induced hemolysis of sheep erythrocyte...

J Med Chem 63: 3104-3119 (2020)


Article DOI: 10.1021/acs.jmedchem.9b01746
BindingDB Entry DOI: 10.7270/Q21Z47V6
More data for this
Ligand-Target Pair