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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'DNA-directed RNA polymerase subunit beta' and Ligand = 'BDBM50155484'   
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-directed RNA polymerase subunit beta


(Escherichia coli)
BDBM50155484
PNG
(CHEMBL185761 | CHEMBL186013 | CHEMBL186014 | {(E)-...)
Show SMILES CCCCC(C)=CC=C(C)C(=O)c1c(O)cc(oc1=O)C(C)CCCC=NC(=O)OC |w:26.27,7.6,4.4|
Show InChI InChI=1S/C24H33NO6/c1-6-7-10-16(2)12-13-18(4)22(27)21-19(26)15-20(31-23(21)28)17(3)11-8-9-14-25-24(29)30-5/h12-15,17,26H,6-11H2,1-5H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 920n/an/an/an/an/an/a



Anadys Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against RNA polymerase of Escherichia coli


Bioorg Med Chem Lett 14: 5667-72 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.045
BindingDB Entry DOI: 10.7270/Q2C53KBD
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)
BDBM50155484
PNG
(CHEMBL185761 | CHEMBL186013 | CHEMBL186014 | {(E)-...)
Show SMILES CCCCC(C)=CC=C(C)C(=O)c1c(O)cc(oc1=O)C(C)CCCC=NC(=O)OC |w:26.27,7.6,4.4|
Show InChI InChI=1S/C24H33NO6/c1-6-7-10-16(2)12-13-18(4)22(27)21-19(26)15-20(31-23(21)28)17(3)11-8-9-14-25-24(29)30-5/h12-15,17,26H,6-11H2,1-5H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.26E+3n/an/an/an/an/an/a



Anadys Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against RNA polymerase of Escherichia coli


Bioorg Med Chem Lett 14: 5667-72 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.045
BindingDB Entry DOI: 10.7270/Q2C53KBD
More data for this
Ligand-Target Pair
DNA-directed RNA polymerase subunit beta


(Escherichia coli)
BDBM50155484
PNG
(CHEMBL185761 | CHEMBL186013 | CHEMBL186014 | {(E)-...)
Show SMILES CCCCC(C)=CC=C(C)C(=O)c1c(O)cc(oc1=O)C(C)CCCC=NC(=O)OC |w:26.27,7.6,4.4|
Show InChI InChI=1S/C24H33NO6/c1-6-7-10-16(2)12-13-18(4)22(27)21-19(26)15-20(31-23(21)28)17(3)11-8-9-14-25-24(29)30-5/h12-15,17,26H,6-11H2,1-5H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.50E+3n/an/an/an/an/an/a



Anadys Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against RNA polymerase of Escherichia coli


Bioorg Med Chem Lett 14: 5667-72 (2004)


Article DOI: 10.1016/j.bmcl.2004.08.045
BindingDB Entry DOI: 10.7270/Q2C53KBD
More data for this
Ligand-Target Pair