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TargetHeat shock protein 75 kDa, mitochondrial
LigandBDBM20926
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1284500 (CHEMBL3106548)
Ki 16±n/a nM
Citation Ernst, JTLiu, MZuccola, HNeubert, TBeaumont, KTurnbull, AKallel, AVought, BStamos, D Correlation between chemotype-dependent binding conformations of HSP90a/ß and isoform selectivity-Implications for the structure-based design of HSP90a/ß selective inhibitors for treating neurodegenerative diseases. Bioorg Med Chem Lett24:204-8 (2013) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Heat shock protein 75 kDa, mitochondrial
Name:Heat shock protein 75 kDa, mitochondrial
Synonyms:HSP75 | TRAP1 | TRAP1_HUMAN
Type:PROTEIN
Mol. Mass.:80120.13
Organism:Homo sapiens (Human)
Description:ChEMBL_1478164
Residue:704
Sequence:
MARELRALLLWGRRLRPLLRAPALAAVPGGKPILCPRRTTAQLGPRRNPAWSLQAGRLFS
TQTAEDKEEPLHSIISSTESVQGSTSKHEFQAETKKLLDIVARSLYSEKEVFIRELISNA
SDALEKLRHKLVSDGQALPEMEIHLQTNAEKGTITIQDTGIGMTQEELVSNLGTIARSGS
KAFLDALQNQAEASSKIIGQFGVGFYSAFMVADRVEVYSRSAAPGSLGYQWLSDGSGVFE
IAEASGVRTGTKIIIHLKSDCKEFSSEARVRDVVTKYSNFVSFPLYLNGRRMNTLQAIWM
MDPKDVREWQHEEFYRYVAQAHDKPRYTLHYKTDAPLNIRSIFYVPDMKPSMFDVSRELG
SSVALYSRKVLIQTKATDILPKWLRFIRGVVDSEDIPLNLSRELLQESALIRKLRDVLQQ
RLIKFFIDQSKKDAEKYAKFFEDYGLFMREGIVTATEQEVKEDIAKLLRYESSALPSGQL
TSLSEYASRMRAGTRNIYYLCAPNRHLAEHSPYYEAMKKKDTEVLFCFEQFDELTLLHLR
EFDKKKLISVETDIVVDHYKEEKFEDRSPAAECLSEKETEELMAWMRNVLGSRVTNVKVT
LRLDTHPAMVTVLEMGAARHFLRMQQLAKTQEERAQLLQPTLEINPRHALIKKLNQLRAS
EPGLAQLLVDQIYENAMIAAGLVDDPRAMVGRLNELLVKALERH
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM20926
n/a
NameBDBM20926
Synonyms:5-[2,4-dihydroxy-5-(propan-2-yl)phenyl]-N-ethyl-4-[4-(morpholin-4-ylmethyl)phenyl]-1,2-oxazole-3-carboxamide | Isoxazole, 40f | VER-52296/NVP-AUY922
TypeSmall organic molecule
Emp. Form.C26H31N3O5
Mol. Mass.465.5414
SMILESCCNC(=O)c1noc(c1-c1ccc(CN2CCOCC2)cc1)-c1cc(C(C)C)c(O)cc1O
Structure
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