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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 373.9
BDBM196145
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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 polymerase


(Vaccinia virus (strain WR))
BDBM196145
PNG
(US9211296, Table 7, Compd: 18)
Show SMILES Clc1nc2ccccc2c2sc(cc12)C(=O)NCCCN1CCCC1
Show InChI InChI=1S/C19H20ClN3OS/c20-18-14-12-16(19(24)21-8-5-11-23-9-3-4-10-23)25-17(14)13-6-1-2-7-15(13)22-18/h1-2,6-7,12H,3-5,8-11H2,(H,21,24)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 1.00E+4n/an/an/an/a7.437



The Trustees of the University of Pennsylvania

US Patent


Assay Description
A rapid plate DNA synthesis assay was performed using optimized conditions. Briefly, a 1.2:1 ratio of a 20-mer oligonucleotide primer (5′-GCGAA...


US Patent US9211296 (2015)


BindingDB Entry DOI: 10.7270/Q2G73CHS
More data for this
Ligand-Target Pair