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Target
Heat shock protein 90 homolog
Ligand
BDBM551831
Substrate
n/a
Meas. Tech.
FP-based equilibrium competition assay
EC50
186±n/a nM
Citation
 Brown, LE; Huang, DS; Cowen, LE; Whitesell, L; Marcyk, P Hsp90 inhibitors and uses thereof US Patent  US11312722 Publication Date 4/26/2022 
Target
Name:
Heat shock protein 90 homolog
Synonyms:
HSP90 | HSP90_CANAL
Type:
Protein
Mol. Mass.:
80784.12
Organism:
Yeast
Description:
P46598
Residue:
707
Sequence:
MADAKVETHEFTAEISQLMSLIINTVYSNKEIFLRELISNASDALDKIRYQALSDPSQLESEPELFIRIIPQKDQKVLEIRDSGIGMTKADLVNNLGTIAKSGTKSFMEALSAGADVSMIGQFGVGFYSLFLVADHVQVISKHNDDEQYVWESNAGGKFTVTLDETNERLGRGTMLRLFLKEDQLEYLEEKRIKEVVKKHSEFVAYPIQLVVTKEVEKEVPETEEEDKAAEEDDKKPKLEEVKDEEDEKKEKKTKTVKEEVTETEELNKTKPLWTRNPSDITQDEYNAFYKSISNDWEDPLAVKHFSVEGQLEFRAILFVPKRAPFDAFESKKKKNNIKLYVRRVFITDDAEELIPEWLSFIKGVVDSEDLPLNLSREMLQQNKILKVIRKNIVKKMIETFNEISEDQEQFNQFYTAFSKNIKLGIHEDAQNRQSLAKLLRFYSTKSSEEMTSLSDYVTRMPEHQKNIYYITGESIKAVEKSPFLDALKAKNFEVLFMVDPIDEYAMTQLKEFEDKKLVDITKDFELEESDEEKAAREKEIKEYEPLTKALKDILGDQVEKVVVSYKLVDAPAAIRTGQFGWSANMERIMKAQALRDTTMSSYMSSKKTFEISPSSPIIKELKKKVETDGAEDKTVKDLTTLLFDTALLTSGFTLDEPSNFAHRINRLIALGLNIDDDSEETAVEPEATTTASTDEPAGESAMEEVD
  
Inhibitor
Name:
BDBM551831
Synonyms:
US11312722, Compound 121
Type:
Small organic molecule
Emp. Form.:
C26H24N4O4
Mol. Mass.:
456.4932
SMILES:
COc1ccc(cc1)-c1cc(Nc2cc(O)cc(O)c2C(=O)N2Cc3ccccc3C2)n(C)n1
Structure:
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