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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 227635   
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
Oxidized purine nucleoside triphosphate hydrolase


(Homo sapiens (Human))
BDBM227635
PNG
(MTH1 inhibitor, 122)
Show SMILES COCCNc1nc(N)nc2[nH]cnc12
Show InChI InChI=1S/C8H12N6O/c1-15-3-2-10-6-5-7(12-4-11-5)14-8(9)13-6/h4H,2-3H2,1H3,(H4,9,10,11,12,13,14)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.80E+3n/an/an/an/a7.5n/a



RIKEN Center for Life Science Technologies



Assay Description
Enzymatic reaction was initiated by adding either 8-oxo-dGTP (13.2 μm; TriLink BioTechnologies) or 2-OH-dATP (8.3 μm; Jena Bioscience) to r...


Chem Biol Drug Des 89: 862-869 (2017)


Article DOI: 10.1111/cbdd.12909
BindingDB Entry DOI: 10.7270/Q24748RZ
More data for this
Ligand-Target Pair
Oxidized purine nucleoside triphosphate hydrolase


(Homo sapiens (Human))
BDBM227635
PNG
(MTH1 inhibitor, 122)
Show SMILES COCCNc1nc(N)nc2[nH]cnc12
Show InChI InChI=1S/C8H12N6O/c1-15-3-2-10-6-5-7(12-4-11-5)14-8(9)13-6/h4H,2-3H2,1H3,(H4,9,10,11,12,13,14)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.10E+3n/an/an/an/a7.5n/a



RIKEN Center for Life Science Technologies



Assay Description
Enzymatic reaction was initiated by adding either 8-oxo-dGTP (13.2 μm; TriLink BioTechnologies) or 2-OH-dATP (8.3 μm; Jena Bioscience) to r...


Chem Biol Drug Des 89: 862-869 (2017)


Article DOI: 10.1111/cbdd.12909
BindingDB Entry DOI: 10.7270/Q24748RZ
More data for this
Ligand-Target Pair