| Reaction Details |
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 | Report a problem with these data |
| Target | Heat shock protein 75 kDa, mitochondrial |
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| Ligand | BDBM50003888 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1336951 (CHEMBL3242259) |
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| Ki | 5800±n/a nM |
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| Citation |  Ernst, JT; Neubert, T; Liu, M; Sperry, S; Zuccola, H; Turnbull, A; Fleck, B; Kargo, W; Woody, L; Chiang, P; Tran, D; Chen, W; Snyder, P; Alcacio, T; Nezami, A; Reynolds, J; Alvi, K; Goulet, L; Stamos, D Identification of novel HSP90a/ß isoform selective inhibitors using structure-based drug design. demonstration of potential utility in treating CNS disorders such as Huntington's disease. J Med Chem57:3382-400 (2014) [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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| BDBM50003888 |
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| n/a |
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| Name | BDBM50003888 |
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| Synonyms: | CHEMBL3235339 |
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| Type | Small organic molecule |
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| Emp. Form. | C24H32N4O2 |
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| Mol. Mass. | 408.5365 |
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| SMILES | CCCNc1cc(ccc1C(N)=O)-n1c2CN(C)CCc2c2c1CC(C)(C)CC2=O |
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| Structure | 
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