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Target
Heat shock protein 90 homolog
Ligand
BDBM551826
Substrate
n/a
Meas. Tech.
FP-based equilibrium competition assay
EC50
594±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:
BDBM551826
Synonyms:
US11312722, Compound 116
Type:
Small organic molecule
Emp. Form.:
C25H20F3N5O3
Mol. Mass.:
495.4532
SMILES:
Cn1nc(cc1Nc1cc(O)cc(O)c1C(=O)N1Cc2cccnc2C1)-c1cccc(c1)C(F)(F)F
Structure:
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