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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Methylcytosine dioxygenase TET2' and Ligand = 'BDBM26106'   
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
Methylcytosine dioxygenase TET2


(Homo sapiens)
BDBM26106
PNG
(CHEMBL90852 | N-oxalyl glycine, 1a | NOG | Oxalylg...)
Show SMILES OC(=O)CNC(=O)C(O)=O
Show InChI InChI=1S/C4H5NO5/c6-2(7)1-5-3(8)4(9)10/h1H2,(H,5,8)(H,6,7)(H,9,10)
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CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
n/an/a 1.13E+4n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1039/d2md00186a
BindingDB Entry DOI: 10.7270/Q2SQ94C0
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Methylcytosine dioxygenase TET2


(Homo sapiens)
BDBM26106
PNG
(CHEMBL90852 | N-oxalyl glycine, 1a | NOG | Oxalylg...)
Show SMILES OC(=O)CNC(=O)C(O)=O
Show InChI InChI=1S/C4H5NO5/c6-2(7)1-5-3(8)4(9)10/h1H2,(H,5,8)(H,6,7)(H,9,10)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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AffyNet 
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CHEMBL
MCE
MMDB
PC cid
PC sid
PDB
UniChem

Patents


Similars

PDB
Article
PubMed
n/an/a 1.97E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human GST-tagged TET2 (1099 to 1936 residues) expressed in Escherichia coli BL21 (DE3)pLysS assessed as reduction in 5hmc l...


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116141
BindingDB Entry DOI: 10.7270/Q2GB27V8
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)