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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Genome polyprotein' and Ligand = 'BDBM89191'   
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
Genome polyprotein


(Dengue virus type 2)
BDBM89191
PNG
(2-[(E)-[[2-(2-furyl)quinoline-4-carbonyl]hydrazono...)
Show SMILES OC(=O)c1ccccc1\C=N\NC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C22H15N3O4/c26-21(25-23-13-14-6-1-2-7-15(14)22(27)28)17-12-19(20-10-5-11-29-20)24-18-9-4-3-8-16(17)18/h1-13H,(H,25,26)(H,27,28)/b23-13+
PDB

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UniChem

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Article
PubMed
n/an/a 4.34E+3n/an/an/an/an/an/a



University of Basel

Curated by ChEMBL


Assay Description
Inhibition of Dengue virus type 2 NS5 RNA methyltransferase by spin-down assay


J Med Chem 53: 1483-95 (2010)


Article DOI: 10.1021/jm900776m
BindingDB Entry DOI: 10.7270/Q2ST7SNQ
More data for this
Ligand-Target Pair
Genome polyprotein


(Dengue virus type 2)
BDBM89191
PNG
(2-[(E)-[[2-(2-furyl)quinoline-4-carbonyl]hydrazono...)
Show SMILES OC(=O)c1ccccc1\C=N\NC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C22H15N3O4/c26-21(25-23-13-14-6-1-2-7-15(14)22(27)28)17-12-19(20-10-5-11-29-20)24-18-9-4-3-8-16(17)18/h1-13H,(H,25,26)(H,27,28)/b23-13+
PDB

UniProtKB/SwissProt

GoogleScholar
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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 4.80E+3n/an/an/an/an/an/a



University of Basel

Curated by ChEMBL


Assay Description
Inhibition of Dengue virus type 2 NS5 RNA methyltransferase RNA site


J Med Chem 53: 1483-95 (2010)


Article DOI: 10.1021/jm900776m
BindingDB Entry DOI: 10.7270/Q2ST7SNQ
More data for this
Ligand-Target Pair
Genome polyprotein


(Dengue virus type 2)
BDBM89191
PNG
(2-[(E)-[[2-(2-furyl)quinoline-4-carbonyl]hydrazono...)
Show SMILES OC(=O)c1ccccc1\C=N\NC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C22H15N3O4/c26-21(25-23-13-14-6-1-2-7-15(14)22(27)28)17-12-19(20-10-5-11-29-20)24-18-9-4-3-8-16(17)18/h1-13H,(H,25,26)(H,27,28)/b23-13+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.91E+3n/an/an/an/an/an/a



University of Basel

Curated by ChEMBL


Assay Description
Inhibition of Dengue virus type 2 NS5 RNA methyltransferase RNA site with 0.1 % TX100


J Med Chem 53: 1483-95 (2010)


Article DOI: 10.1021/jm900776m
BindingDB Entry DOI: 10.7270/Q2ST7SNQ
More data for this
Ligand-Target Pair