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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'UDP-N-acetylbacillosamine N-acetyltransferase' and Ligand = 'BDBM50501668'   
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
UDP-N-acetylbacillosamine N-acetyltransferase


(Campylobacter jejuni subsp. jejuni serotype O:2 (s...)
BDBM50501668
PNG
(CHEMBL4102869)
Show SMILES Cc1c(sc2nc(CCc3ccccc3)nc(NCCc3cccnc3)c12)C(O)=O
Show InChI InChI=1S/C23H22N4O2S/c1-15-19-21(25-13-11-17-8-5-12-24-14-17)26-18(10-9-16-6-3-2-4-7-16)27-22(19)30-20(15)23(28)29/h2-8,12,14H,9-11,13H2,1H3,(H,28,29)(H,25,26,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 340n/an/an/an/an/an/a



Massachusetts Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of Campylobacter jejuni NCTC 11168 PglD acetyltransferase expressed in Escherichia coli BL-21(DE3) strain (Stratagene) assessed as release...


J Med Chem 60: 2099-2118 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01869
BindingDB Entry DOI: 10.7270/Q2JD50TC
More data for this
Ligand-Target Pair