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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 378.7
BDBM50550745

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 (cytosine-5)-methyltransferase 3B


(Homo sapiens (Human))
BDBM50550745
PNG
(CHEMBL4745197)
Show SMILES COc1ccc(c(c1)C1Oc2ccccc2C(=O)C1(Cl)[N+]([O-])=O)[N+]([O-])=O
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 4.40E+3n/an/an/an/a


TBA

Assay Description
Inhibition of human DNMT3B expressed in Escherichia coli Rosetta-gamiTM 2(DE3) pLysS competent cells using biotinylated 6-FAM double strand DNA compr...


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.111829
BindingDB Entry DOI: 10.7270/Q2NS0ZHR
More data for this
Ligand-Target Pair