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Target
Oxidized purine nucleoside triphosphate hydrolase
Ligand
BDBM50155447
Substrate
n/a
Meas. Tech.
ChEMBL_1839104 (CHEMBL4339319)
IC50
>100000±n/a nM
Citation
 Yokoyama, T; Kitakami, R; Mizuguchi, M Discovery of a new class of MTH1 inhibitor by X-ray crystallographic screening. Eur J Med Chem 167:153-160 (2019) [PubMed]  Article 
Target
Name:
Oxidized purine nucleoside triphosphate hydrolase
Synonyms:
2-hydroxy-dATP diphosphatase | 3.6.1.- | 3.6.1.56 | 7,8-dihydro-8-oxoguanine triphosphatase | 8-oxo-dGTPase | 8ODP_HUMAN | MTH1 | Methylated purine nucleoside triphosphate hydrolase | MutT homolog 1 protein (MTH1) | NUDT1 | Nucleoside diphosphate-linked moiety X motif 1 | Nudix motif 1 | Oxidized purine nucleoside triphosphate hydrolase [42-197]
Type:
Protein
Mol. Mass.:
22514.81
Organism:
Homo sapiens (Human)
Description:
P36639
Residue:
156
Sequence:
MGASRLYTLVLVLQPQRVLLGMKKRGFGAGRWNGFGGKVQEGETIEDGARRELQEESGLTVDALHKVGQIVFEFVGEPELMDVHVFCTDSIQGTPVESDEMRPCWFQLDQIPFKDMWPDDSYWFPLLLQKKKFHGYFKFQGQDTILDYTLREVDTV
  
Inhibitor
Name:
BDBM50155447
Synonyms:
1,3,6,7-Tetrahydroxy-xanthen-9-one | 1,3,6,7-tetrahydroxyxantone | CHEMBL187265
Type:
Small organic molecule
Emp. Form.:
C13H8O6
Mol. Mass.:
260.199
SMILES:
Oc1cc(O)c2c(c1)oc1cc(O)c(O)cc1c2=O
Structure:
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