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TargetHeat shock protein HSP 90-beta
LigandBDBM50013700
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1349362 (CHEMBL3269585)
IC50 65000±n/a nM
Citation Bhat, RAdam, ATLee, JJGasiewicz, TAHenry, ECRotella, DP Towards the discovery of drug-like epigallocatechin gallate analogs as Hsp90 inhibitors. Bioorg Med Chem Lett24:2263-6 (2014) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Heat shock protein HSP 90-beta
Name:Heat shock protein HSP 90-beta
Synonyms:HS90B_HUMAN | HSP 84 | HSP 90 | HSP90AB1 | HSP90B | HSPC2 | HSPCB | Heat Shock Protein 90 (Hsp90) | Heat shock protein HSP 90 (Hsp90)
Type:Molecular Chaperone
Mol. Mass.:83229.45
Organism:Homo sapiens (Human)
Description:P08238
Residue:724
Sequence:
MPEEVHHGEEEVETFAFQAEIAQLMSLIINTFYSNKEIFLRELISNASDALDKIRYESLT
DPSKLDSGKELKIDIIPNPQERTLTLVDTGIGMTKADLINNLGTIAKSGTKAFMEALQAG
ADISMIGQFGVGFYSAYLVAEKVVVITKHNDDEQYAWESSAGGSFTVRADHGEPIGRGTK
VILHLKEDQTEYLEERRVKEVVKKHSQFIGYPITLYLEKEREKEISDDEAEEEKGEKEEE
DKDDEEKPKIEDVGSDEEDDSGKDKKKKTKKIKEKYIDQEELNKTKPIWTRNPDDITQEE
YGEFYKSLTNDWEDHLAVKHFSVEGQLEFRALLFIPRRAPFDLFENKKKKNNIKLYVRRV
FIMDSCDELIPEYLNFIRGVVDSEDLPLNISREMLQQSKILKVIRKNIVKKCLELFSELA
EDKENYKKFYEAFSKNLKLGIHEDSTNRRRLSELLRYHTSQSGDEMTSLSEYVSRMKETQ
KSIYYITGESKEQVANSAFVERVRKRGFEVVYMTEPIDEYCVQQLKEFDGKSLVSVTKEG
LELPEDEEEKKKMEESKAKFENLCKLMKEILDKKVEKVTISNRLVSSPCCIVTSTYGWTA
NMERIMKAQALRDNSTMGYMMAKKHLEINPDHPIVETLRQKAEADKNDKAVKDLVVLLFE
TALLSSGFSLEDPQTHSNRIYRMIKLGLGIDEDEVAAEEPNAAVPDEIPPLEGDEDASRM
EEVD
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50013700
n/a
NameBDBM50013700
Synonyms:CHEMBL3264535
TypeSmall organic molecule
Emp. Form.C22H23FO7
Mol. Mass.418.4122
SMILESOc1cc(O)c2C[C@@H](OC(=O)[C@@H]3CC[C@H](F)CC3)[C@H](Oc2c1)c1ccc(O)c(O)c1 |r,wU:11.10,14.14,wD:18.24,7.7,(-.5,-47.41,;.84,-48.18,;.84,-49.73,;2.17,-50.5,;2.17,-52.04,;3.5,-49.73,;4.84,-50.51,;6.19,-49.73,;7.52,-50.51,;7.51,-52.05,;6.18,-52.81,;8.84,-52.82,;8.83,-54.36,;10.16,-55.13,;11.5,-54.37,;12.83,-55.14,;11.5,-52.82,;10.17,-52.05,;6.19,-48.18,;4.84,-47.4,;3.5,-48.18,;2.17,-47.41,;7.52,-47.41,;8.85,-48.19,;10.19,-47.43,;10.19,-45.89,;11.53,-45.12,;8.85,-45.11,;8.85,-43.57,;7.52,-45.88,)|
Structure
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