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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Lanosterol synthase ERG7 | ||
| Ligand | BDBM50255430 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_515548 (CHEMBL1036569) | ||
| IC50 | 270±n/a nM | ||
| Citation |  Balliano, G; Dehmlow, H; Oliaro-Bosso, S; Scaldaferri, M; Taramino, S; Viola, F; Caron, G; Aebi, J; Ackermann, J Oxidosqualene cyclase from Saccharomyces cerevisiae, Trypanosoma cruzi, Pneumocystis carinii and Arabidopsis thaliana expressed in yeast: a model for the development of novel antiparasitic agents. Bioorg Med Chem Lett19:718-23 (2009) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Lanosterol synthase ERG7 | |||
| Name: | Lanosterol synthase ERG7 | ||
| Synonyms: | ERG7 | ERG7_YEAST | Lanosterol synthase | ||
| Type: | PROTEIN | ||
| Mol. Mass.: | 83460.43 | ||
| Organism: | Saccharomyces cerevisiae | ||
| Description: | ChEMBL_956105 | ||
| Residue: | 731 | ||
| Sequence: |
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| BDBM50255430 | |||
| n/a | |||
| Name | BDBM50255430 | ||
| Synonyms: | CHEMBL473035 | N-(4-(5-(ethyl(2-hydroxyethyl)amino)pentyl)cyclohexyl)-N-methyl-4-(trifluoromethyl)benzenesulfonamide fumarate | ||
| Type | Small organic molecule | ||
| Emp. Form. | C23H37F3N2O3S | ||
| Mol. Mass. | 478.612 | ||
| SMILES | CCN(CCO)CCCCC[C@H]1CC[C@@H](CC1)N(C)S(=O)(=O)c1ccc(cc1)C(F)(F)F |r,wU:14.17,wD:11.10,(2.96,-12.19,;4.3,-12.96,;4.3,-14.5,;2.96,-15.27,;1.63,-14.5,;.3,-15.27,;5.63,-15.27,;6.96,-14.5,;8.3,-15.27,;9.63,-14.5,;10.96,-15.27,;12.3,-14.5,;13.62,-15.27,;14.95,-14.51,;14.96,-12.97,;13.63,-12.19,;12.29,-12.96,;16.3,-12.2,;16.3,-10.66,;17.63,-12.98,;18.95,-13.74,;16.86,-14.31,;18.41,-11.65,;19.95,-11.66,;20.73,-10.34,;19.97,-9,;18.42,-8.99,;17.65,-10.32,;20.74,-7.67,;21.51,-6.32,;22.08,-8.44,;19.41,-6.9,)| | ||
| Structure | 
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