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Target
Peptidyl-prolyl cis-trans isomerase ESS1
Ligand
BDBM53406
Substrate
n/a
Meas. Tech.
Pin1 Inhibition Assay
pH
7±0
Temperature
273.15±n/a K
IC50
>1.0e+4±n/a nM
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 Biol 10:15-24 (2003) [PubMed]  Article 
Target
Name:
Peptidyl-prolyl cis-trans isomerase ESS1
Synonyms:
ESS1 | ESS1_YEAST | PIN1 | PTF1 | Parvulin ESS1 | Peptidyl-prolyl cis-trans isomerase
Type:
Protein
Mol. Mass.:
19411.52
Organism:
Saccharomyces cerevisiae (Baker's yeast)
Description:
P22696
Residue:
170
Sequence:
MPSDVASRTGLPTPWTVRYSKSKKREYFFNPETKHSQWEEPEGTNKDQLHKHLRDHPVRVRCLHILIKHKDSRRPASHRSENITISKQDATDELKTLITRLDDDSKTNSFEALAKERSDCSSYKRGGDLGWFGRGEMQPSFEDAAFQLKVGEVSDIVESGSGVHVIKRVG
  
Inhibitor
Name:
BDBM53406
Synonyms:
(6Z)-1-benzoyl-4-(4-fluorobenzyl)-5-(4-methoxyphenyl)-5,8-dihydro-2H-1,4-diazocin-3-one | (6Z)-1-benzoyl-4-[(4-fluorophenyl)methyl]-5-(4-methoxyphenyl)-5,8-dihydro-2H-1,4-diazocin-3-one | (6Z)-4-[(4-fluorophenyl)methyl]-5-(4-methoxyphenyl)-1-(phenylcarbonyl)-5,8-dihydro-2H-1,4-diazocin-3-one | MLS000863187 | PiH | SMR000465277 | cid_16746512
Type:
Small organic molecule
Emp. Form.:
C27H25FN2O3
Mol. Mass.:
444.4974
SMILES:
COc1ccc(cc1)C1\C=C/CN(CC(=O)N1Cc1ccc(F)cc1)C(=O)c1ccccc1 |c:10|
Structure:
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