BDBM87387 2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-pyridin-4-yl-pyridine-3-carbonitrile::2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl-6-pyridin-4-ylpyridine-3-carbonitrile::2-[[2-(4-methyl-1-piperazinyl)-2-oxoethyl]thio]-6-pyridin-4-yl-3-pyridinecarbonitrile::2-[[2-keto-2-(4-methylpiperazino)ethyl]thio]-6-(4-pyridyl)nicotinonitrile::MLS000028043::SMR000038833::cid_657902

SMILES CN1CCN(CC1)C(=O)CSc1nc(ccc1C#N)-c1ccncc1

InChI Key InChIKey=DBBOMVVEULTKAO-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 87387   

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

Curated by PubChem BioAssay
LigandPNGBDBM87387(2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethy...)
Affinity DataIC50:  3.90E+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
In DepthDetails PCBioAssay