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BDBM119117 MurF inhibitor (compound 59)

SMILES: OCCc1ccccc1Nc1nc(Cl)nc(Cl)n1

InChI Key: InChIKey=LMPQRYXIMQDJIS-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 119117   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
DNA topoisomerase 2-alpha


(Homo sapiens (Human))
BDBM119117
PNG
(MurF inhibitor (compound 59))
Show SMILES OCCc1ccccc1Nc1nc(Cl)nc(Cl)n1
Show InChI InChI=1S/C11H10Cl2N4O/c12-9-15-10(13)17-11(16-9)14-8-4-2-1-3-7(8)5-6-18/h1-4,18H,5-6H2,(H,14,15,16,17)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



National Institute of Chemistry

Curated by ChEMBL


Assay Description
Inhibition of human DNA topoisomerase IIalpha using plasmid pNO1 as a substrate after 30 mins


Bioorg Med Chem 23: 4218-29 (2015)


BindingDB Entry DOI: 10.7270/Q2RJ4M72
More data for this
Ligand-Target Pair
UDP-N-acetylmuramoyl-tripeptide--D-alanyl-D-alanine ligase


(Escherichia coli)
BDBM119117
PNG
(MurF inhibitor (compound 59))
Show SMILES OCCc1ccccc1Nc1nc(Cl)nc(Cl)n1
Show InChI InChI=1S/C11H10Cl2N4O/c12-9-15-10(13)17-11(16-9)14-8-4-2-1-3-7(8)5-6-18/h1-4,18H,5-6H2,(H,14,15,16,17)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.50E+5n/an/an/an/an/an/a



University of Ljubljana, A?kerceva 7, 1000 Ljubljana, Slovenia





Bioorg Chem 55: 2-15 (2014)


Article DOI: 10.1016/j.bioorg.2014.03.008
BindingDB Entry DOI: 10.7270/Q2ZG6QWR
More data for this
Ligand-Target Pair