| Reaction Details |
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 | Report a problem with these data |
| Target | Peptidyl-prolyl cis-trans isomerase ESS1 |
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| Ligand | BDBM53401 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | Pin1 Inhibition Assay |
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| pH | 7±0 |
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| Temperature | 273.15±n/a K |
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| IC50 | 2.0e+3±n/a nM |
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| Citation |  Uchida, T; Takamiya, M; Takahashi, M; Miyashita, H; Ikeda, H; Terada, T; Matsuo, Y; Shirouzu, M; Yokoyama, S; Fujimori, F; Hunter, T Pin1 and Par14 peptidyl prolyl isomerase inhibitors block cell proliferation. Chem Biol10:15-24 (2003) [PubMed] Article |
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| More Info.: | Get all data from this article, Solution Info, Assay Method |
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| Peptidyl-prolyl cis-trans isomerase ESS1 |
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| Name: | Peptidyl-prolyl cis-trans isomerase ESS1 |
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| Synonyms: | ESS1 | ESS1_YEAST | PIN1 | PTF1 | Parvulin ESS1 | Peptidyl-prolyl cis-trans isomerase |
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| Type: | Protein |
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| Mol. Mass.: | 19411.52 |
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| Organism: | Saccharomyces cerevisiae (Baker's yeast) |
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| Description: | P22696 |
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| Residue: | 170 |
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| Sequence: | MPSDVASRTGLPTPWTVRYSKSKKREYFFNPETKHSQWEEPEGTNKDQLHKHLRDHPVRV
RCLHILIKHKDSRRPASHRSENITISKQDATDELKTLITRLDDDSKTNSFEALAKERSDC
SSYKRGGDLGWFGRGEMQPSFEDAAFQLKVGEVSDIVESGSGVHVIKRVG
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| BDBM53401 |
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| n/a |
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| Name | BDBM53401 |
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| Synonyms: | (3R,3aS,7R,7aS)-2-benzyl-3-(3-chloro-4-methoxy-phenyl)-7-ethyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one | (3R,3aS,7R,7aS)-2-benzyl-3-(3-chloro-4-methoxyphenyl)-7-ethyl-3a,6,7,7a-tetrahydro-3H-isoindol-1-one | (3R,3aS,7R,7aS)-3-(3-chloranyl-4-methoxy-phenyl)-7-ethyl-2-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-isoindol-1-one | (3R,3aS,7R,7aS)-3-(3-chloro-4-methoxyphenyl)-7-ethyl-2-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-isoindol-1-one | MLS000882828 | PiA | SMR000465391 | cid_16746348 |
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| Type | Small organic molecule |
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| Emp. Form. | C24H26ClNO2 |
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| Mol. Mass. | 395.922 |
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| SMILES | CC[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(Cc1ccccc1)[C@H]2c1ccc(OC)c(Cl)c1 |c:4| |
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| Structure | 
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