BDBM71698 MLS000041949::N-[(1S)-2-[(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-1-benzyl-2-keto-ethyl]-4-methoxy-benzenesulfonamide::N-[(2S)-1-[(4aS,8aS)-4a-hydroxy-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-1-oxo-3-phenylpropan-2-yl]-4-methoxybenzenesulfonamide::N-[(2S)-1-[(4aS,8aS)-4a-oxidanyl-1,3,4,5,6,7,8,8a-octahydroisoquinolin-2-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methoxy-benzenesulfonamide::SMR000046528::cid_665407

SMILES COc1ccc(cc1)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@]2(O)CCCC[C@H]2C1

InChI Key InChIKey=OKWKOOCCWHZTRK-UHFFFAOYSA-N

Data  1 EC50

  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 = 71698   

TargetHeat shock factor protein 1(Mouse)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM71698(N-[(2S)-1-[(4aS,8aS)-4a-oxidanyl-1,3,4,5,6,7,8,8a-...)
Affinity DataEC50: >2.60E+5nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/30/2011
Entry Details
PCBioAssay