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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peptide deformylase' and Ligand = 'BDBM50535502'   
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
Peptide deformylase


(Staphylococcus aureus)		BDBM50535502
PNG
(GSK-1322322B | GSK1322322 | GSK1322322B | Lanopepd...)
Show SMILES [H][C@@](CC1CCCC1)(CN(O)C=O)C(=O)NNc1nc(C)nc(N2CCN3CCOC[C@]3([H])C2)c1F |r|
Show InChI InChI=1S/C22H34FN7O4/c1-15-24-20(19(23)21(25-15)29-7-6-28-8-9-34-13-18(28)12-29)26-27-22(32)17(11-30(33)14-31)10-16-4-2-3-5-16/h14,16-18,33H,2-13H2,1H3,(H,27,32)(H,24,25,26)/t17-,18+/m1/s1
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MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 12n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of Staphylococcus aureus PDF by absorbance detection assay

Bioorg Med Chem Lett 29: 2410-2414 (2019)


Article DOI: 10.1016/j.bmcl.2019.05.028
BindingDB Entry DOI: 10.7270/Q2FF3WV7
More data for this
Ligand-Target Pair