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PubMed code 22014547

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
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
DNA topoisomerase I (Topo I)


(Homo sapiens (Human))
BDBM50358566
PNG
(UNGEREMINE)
Show SMILES [O-]c1cc2CC[n+]3cc4cc5OCOc5cc4c(c1)c23
Show InChI InChI=1S/C16H11NO3/c18-11-3-9-1-2-17-7-10-4-14-15(20-8-19-14)6-12(10)13(5-11)16(9)17/h3-7H,1-2,8H2
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PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.10E+3n/an/an/an/an/an/a



University of Cagliari

Curated by ChEMBL


Assay Description
Inhibition of human topoisomerase 1-mediated relaxation of supercoiled pBR322 DNA


Bioorg Med Chem Lett 21: 7041-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.09.097
BindingDB Entry DOI: 10.7270/Q2B858K9
More data for this
Ligand-Target Pair
Topoisomerase II alpha (HuTopoIIα)


(Homo sapiens (Human))
BDBM50358566
PNG
(UNGEREMINE)
Show SMILES [O-]c1cc2CC[n+]3cc4cc5OCOc5cc4c(c1)c23
Show InChI InChI=1S/C16H11NO3/c18-11-3-9-1-2-17-7-10-4-14-15(20-8-19-14)6-12(10)13(5-11)16(9)17/h3-7H,1-2,8H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.58E+4n/an/an/an/an/an/a



University of Cagliari

Curated by ChEMBL


Assay Description
Inhibition of human topoisomerase 2alpha-mediated relaxation of supercoiled pBR322 DNA


Bioorg Med Chem Lett 21: 7041-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.09.097
BindingDB Entry DOI: 10.7270/Q2B858K9
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%