BDBM50106510 2-{12-[2-Amino-6-(4-bromo-thiophen-2-ylmethoxy)-purin-9-yl]-dodecyloxy}-6-hydroxymethyl-tetrahydro-pyran-3,4,5-triol::CHEMBL129850

SMILES Nc1nc(OCc2cc(Br)cs2)c2ncn(CCCCCCCCCCCCO[C@H]3OC(CO)[C@@H](O)[C@@H](O)C3O)c2n1

InChI Key InChIKey=PSVPDTKUYKVHTK-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50106510   

TargetMethylated-DNA--protein-cysteine methyltransferase(Human)
German Cancer Research Center

Curated by ChEMBL
LigandPNGBDBM50106510(2-{12-[2-Amino-6-(4-bromo-thiophen-2-ylmethoxy)-pu...)
Affinity DataIC50: 30nMAssay Description:In vitro inhibition of MGMT using cell free extracts from HeLa S3 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed