| Reaction Details |
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 | Report a problem with these data |
| Target | Heat shock protein 75 kDa, mitochondrial |
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| Ligand | BDBM50165300 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1478164 (CHEMBL3427925) |
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| IC50 | 203700±n/a nM |
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| Citation |  Patel, HJ; Patel, PD; Ochiana, SO; Yan, P; Sun, W; Patel, MR; Shah, SK; Tramentozzi, E; Brooks, J; Bolaender, A; Shrestha, L; Stephani, R; Finotti, P; Leifer, C; Li, Z; Gewirth, DT; Taldone, T; Chiosis, G Structure-activity relationship in a purine-scaffold compound series with selectivity for the endoplasmic reticulum Hsp90 paralog Grp94. J Med Chem58:3922-43 (2015) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Heat shock protein 75 kDa, mitochondrial |
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| Name: | Heat shock protein 75 kDa, mitochondrial |
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| Synonyms: | HSP75 | TRAP1 | TRAP1_HUMAN |
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| Type: | PROTEIN |
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| Mol. Mass.: | 80120.13 |
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| Organism: | Homo sapiens (Human) |
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| Description: | ChEMBL_1478164 |
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| Residue: | 704 |
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| Sequence: | MARELRALLLWGRRLRPLLRAPALAAVPGGKPILCPRRTTAQLGPRRNPAWSLQAGRLFS
TQTAEDKEEPLHSIISSTESVQGSTSKHEFQAETKKLLDIVARSLYSEKEVFIRELISNA
SDALEKLRHKLVSDGQALPEMEIHLQTNAEKGTITIQDTGIGMTQEELVSNLGTIARSGS
KAFLDALQNQAEASSKIIGQFGVGFYSAFMVADRVEVYSRSAAPGSLGYQWLSDGSGVFE
IAEASGVRTGTKIIIHLKSDCKEFSSEARVRDVVTKYSNFVSFPLYLNGRRMNTLQAIWM
MDPKDVREWQHEEFYRYVAQAHDKPRYTLHYKTDAPLNIRSIFYVPDMKPSMFDVSRELG
SSVALYSRKVLIQTKATDILPKWLRFIRGVVDSEDIPLNLSRELLQESALIRKLRDVLQQ
RLIKFFIDQSKKDAEKYAKFFEDYGLFMREGIVTATEQEVKEDIAKLLRYESSALPSGQL
TSLSEYASRMRAGTRNIYYLCAPNRHLAEHSPYYEAMKKKDTEVLFCFEQFDELTLLHLR
EFDKKKLISVETDIVVDHYKEEKFEDRSPAAECLSEKETEELMAWMRNVLGSRVTNVKVT
LRLDTHPAMVTVLEMGAARHFLRMQQLAKTQEERAQLLQPTLEINPRHALIKKLNQLRAS
EPGLAQLLVDQIYENAMIAAGLVDDPRAMVGRLNELLVKALERH
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| BDBM50165300 |
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| n/a |
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| Name | BDBM50165300 |
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| Synonyms: | 8-(2,5-Dimethyl-phenylsulfanyl)-9-pent-4-ynyl-9H-purin-6-ylamine | CHEMBL364239 |
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| Type | Small organic molecule |
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| Emp. Form. | C18H19N5S |
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| Mol. Mass. | 337.442 |
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| SMILES | Cc1ccc(C)c(Sc2nc3c(N)ncnc3n2CCCC#C)c1 |
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| Structure | 
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