BDBM279606 N-cyano-5-(2,4-dihydroxyl-5-isopropylphenyl)-4-(2-methyl-1,2,3,4-tetrahydroisoquinolin-6-yl)isoxazole-3-carboxamidine::US10035792, Example 21

SMILES CC(C)c1cc(-c2onc(C(=N)NC#N)c2-c2ccc3CN(C)CCc3c2)c(O)cc1O

InChI Key InChIKey=KEDJAQVNGFJXAJ-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 = 279606   

TargetHeat shock protein HSP 90-alpha(Homo sapiens (Human))
Chia Tai Tianqing Pharmaceutical Group

US Patent
LigandPNGBDBM279606(N-cyano-5-(2,4-dihydroxyl-5-isopropylphenyl)-4-(2-...)
Affinity DataIC50: <20nMpH: 7.4Assay Description:The fluorescent labeled small molecule used in the present invention was VER-00051001 (synthesized by reference to the synthetic method described in ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent