BDBM279635 5-(2,4-dihydroxyl-5-isopropylphenyl)-N-ethyl-4-(2-propyl-1,2,3,4-tetrahydroisoquinolin-6-yl)isoxazole-3-carboxamide::US10035792, Example 50

SMILES CCCN1CCc2cc(ccc2C1)-c1c(noc1-c1cc(C(C)C)c(O)cc1O)C(=O)NCC

InChI Key InChIKey=IHUHAFRJAUDLGR-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 279635   

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

US Patent
LigandPNGBDBM279635(US10035792, Example 50 | 5-(2,4-dihydroxyl-5-isopr...)
Affinity DataIC50: 60nMpH: 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
In Depth
Date in BDB:
12/25/2018
Entry Details
US Patent