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Target
C-8 sterol isomerase ERG2
Ligand
BDBM50170661
Substrate
n/a
Meas. Tech.
ChEMBL_303390 (CHEMBL839961)
Ki
74±n/a nM
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 Chem 48:4754-64 (2005) [PubMed]  Article 
Target
Name:
C-8 sterol isomerase ERG2
Synonyms:
C-8 sterol isomerase | Delta-8--delta-7 sterol isomerase | ERG2 | ERG2_YEAST
Type:
PROTEIN
Mol. Mass.:
24892.29
Organism:
Saccharomyces cerevisiae
Description:
ChEMBL_303390
Residue:
222
Sequence:
MKFFPLLLLIGVVGYIMNVLFTTWLPTNYMFDPKTLNEICNSVISKHNAAEGLSTEDLLQDVRDALASHYGDEYINRYVKEEWVFNNAGGAMGQMIILHASVSEYLILFGTAVGTEGHTGVHFADDYFTILHGTQIAALPYATEAEVYTPGMTHHLKKGYAKQYSMPGGSFALELAQGWIPCMLPFGFLDTFSSTLDLYTLYRTVYLTARDMGKNLLQNKKF
  
Inhibitor
Name:
BDBM50170661
Synonyms:
(S)-2-Isopropyl-5-(methyl-phenethyl-amino)-2-phenyl-pentanenitrile | CHEMBL187829 | Levemopamil
Type:
Small organic molecule
Emp. Form.:
C23H30N2
Mol. Mass.:
334.4977
SMILES:
CC(C)[C@](CCCN(C)CCc1ccccc1)(C#N)c1ccccc1
Structure:
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