BDBM87441 (3aS,5S,9aS)-2-(2-methylbenzyl)-5-piazthiol-5-yl-3a,4,5,7,8,9-hexahydro-3H-pyrrolo[3,4-h]pyrrolizin-1-one::(3aS,5S,9aS)-5-(2,1,3-benzothiadiazol-5-yl)-2-(2-methylbenzyl)hexahydro-7H-pyrrolo[3,4-g]pyrrolizin-1(2H)-one::(3aS,5S,9aS)-5-(2,1,3-benzothiadiazol-5-yl)-2-[(2-methylphenyl)methyl]-3a,4,5,7,8,9-hexahydro-3H-pyrrolo[3,4-h]pyrrolizin-1-one::MLS000733064::SMR000316220::cid_16191136

SMILES Cc1ccccc1CN1C[C@@H]2C[C@H](N3CCC[C@@]23C1=O)c1ccc2nsnc2c1

InChI Key InChIKey=GYWZAAMIPPLUMN-HARLFGEKSA-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 = 87441   

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

Curated by PubChem BioAssay
LigandPNGBDBM87441((3aS,5S,9aS)-2-(2-methylbenzyl)-5-piazthiol-5-yl-3...)
Affinity DataIC50:  3.41E+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