BDBM87498 7-[2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-1,3-dimethylpurine-2,6-dione::7-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-1,3-dimethyl-purine-2,6-dione::7-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-1,3-dimethylpurine-2,6-dione::7-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-2-keto-ethyl]-1,3-dimethyl-xanthine::MLS002171563::SMR001251857::cid_3416856

SMILES Cc1ccc(cc1C)S(=O)(=O)N1CCN(CC1)C(=O)Cn1cnc2n(C)c(=O)n(C)c(=O)c12

InChI Key InChIKey=QBBJDRDSIXWAPH-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 = 87498   

TargetTyrosine-protein kinase ABL1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM87498(7-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl...)
Affinity DataIC50: 2.15E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...More data for this Ligand-Target Pair
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Date in BDB:
6/18/2012
Entry Details
PCBioAssay