| Reaction Details |
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 | Report a problem with these data |
| Target | C-8 sterol isomerase ERG2 |
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| Ligand | BDBM50170649 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_303390 (CHEMBL839961) |
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| Ki | 500±n/a nM |
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| Citation |  Laggner, C; Schieferer, C; Fiechtner, B; Poles, G; Hoffmann, RD; Glossmann, H; Langer, T; Moebius, FF Discovery of high-affinity ligands of sigma1 receptor, ERG2, and emopamil binding protein by pharmacophore modeling and virtual screening. J Med Chem48:4754-64 (2005) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| C-8 sterol isomerase ERG2 |
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| Name: | C-8 sterol isomerase ERG2 |
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| Synonyms: | C-8 sterol isomerase | Delta-8--delta-7 sterol isomerase | ERG2 | ERG2_YEAST |
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| Type: | PROTEIN |
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| Mol. Mass.: | 24892.29 |
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| Organism: | Saccharomyces cerevisiae |
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| Description: | ChEMBL_303390 |
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| Residue: | 222 |
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| Sequence: | MKFFPLLLLIGVVGYIMNVLFTTWLPTNYMFDPKTLNEICNSVISKHNAAEGLSTEDLLQ
DVRDALASHYGDEYINRYVKEEWVFNNAGGAMGQMIILHASVSEYLILFGTAVGTEGHTG
VHFADDYFTILHGTQIAALPYATEAEVYTPGMTHHLKKGYAKQYSMPGGSFALELAQGWI
PCMLPFGFLDTFSSTLDLYTLYRTVYLTARDMGKNLLQNKKF
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| BDBM50170649 |
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| n/a |
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| Name | BDBM50170649 |
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| Synonyms: | 2',3,6,7a,15'-Pentamethyl-(1'S,2'R,2'R,3R,3aS,5'S,6S,7aR,10'S,11'S)-spiro[perhydrofuro[3,2-b]pyridine-2,14'-tetracyclo[8.7.0.02,7.011,16]heptadeca-7',15'-diene]-5'-ol | CHEMBL366154 |
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| Type | Small organic molecule |
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| Emp. Form. | C28H43NO2 |
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| Mol. Mass. | 425.6465 |
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| SMILES | C[C@@H]1[C@@H]2NC[C@@H](C)C[C@@]2(C)O[C@]11CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC2=C1C |c:33,t:19| |
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| Structure | 
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