Reaction Details Report a problem with these data
Target
Hsp90 chaperone protein kinase-targeting subunit
Ligand
BDBM551760
Substrate
n/a
Meas. Tech.
FP-based equilibrium competition assay
EC50
26.0±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:
Hsp90 chaperone protein kinase-targeting subunit
Synonyms:
F5H9H0_CRYNB
Type:
Protein
Mol. Mass.:
57233.28
Organism:
Filobasidiella neoformans
Description:
F5H9H0
Residue:
505
Sequence:
MPLNYSKWDMLELSDDSDIEEHPNVDKKSMIRWKQRDIHEKREARKLLISKLKSELSLNSVLRPRIETIISGLSSSGLDHYRAVQRRMKEDPSPEKPETGAPNQPTYDMMLSQLLSDVFREGAWLVEGGRIEGNGVLYNGKKVDDNTGLPDWATAEVPEGKKELLAEKLEQRLRWHVSELNRRDEQVKKEIEKEEGELKKKITSDDIHEGWSSSKIAPPKPSVWDETPRPKKDKKTEKVETIEVLNPKASSSAAPVAPATEDTDDEEDFGPLSPAGRAFAQIPLGDFEKAYDFIKNDSSVLSSSTHDSLLAEAFDAERRGDKSLAMRCVHQSLLVNYCRQLGKDGVGLFFQKMIQKNPKSITMFNEDFQRTYNRIATRTREILAEEAAAGPSGEREQIQLVATDPNMTIAFNLPDGPPPEKILLEGEGVEELDMEQVRAWLQRKWEIFKSFPPRFQEALQTENLDKVNQALGDMKVSEAEKIVELLQEGGMLSFSEKGVRDMTNQ
  
Inhibitor
Name:
BDBM551760
Synonyms:
US11312722, Compound 50
Type:
Small organic molecule
Emp. Form.:
C28H27N5O4
Mol. Mass.:
497.5451
SMILES:
COc1ccc(Cn2nc(cc2Nc2cc(O)cc(O)c2C(=O)N2Cc3cccnc3C2)C2CC2)cc1
Structure:
Search PDB for entries with ligand similarity: