BDBM279613 3-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl) isoxazole-5-carboxamide::US10035792, Example 28

SMILES CCNC(=O)c1onc(c1-c1ccc2CCNCCc2c1)-c1cc(C(C)C)c(O)cc1O

InChI Key InChIKey=TWIFFNRRGMHOSR-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 279613   

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

US Patent
LigandPNGBDBM279613(3-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-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