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Target
Protein-tyrosine-phosphatase
Ligand
BDBM50170985
Substrate
n/a
Meas. Tech.
ChEMBL_305615 (CHEMBL828153)
IC50
>100000±n/a nM
Citation
 Lee, K; Boovanahalli, SK; Nam, KY; Kang, SU; Lee, M; Phan, J; Wu, L; Waugh, DS; Zhang, ZY; No, KT; Lee, JJ; Burke, TR Synthesis of tripeptides as potent Yersinia protein tyrosine phosphatase inhibitors. Bioorg Med Chem Lett 15:4037-42 (2005) [PubMed]  Article 
Target
Name:
Protein-tyrosine-phosphatase
Synonyms:
Secreted effector protein | Secreted protein-tyrosine phosphatase
Type:
PROTEIN
Mol. Mass.:
50881.86
Organism:
Yersinia pestis
Description:
ChEMBL_810616
Residue:
468
Sequence:
MNLSLSDLHRQVSRLVQQESGDCTGKLRGNVAANKETTFQGLTIASGARESEKVFAQTVLSHVANVVLTQEDTAKLLQSTVKHNLNNYDLRSVGNGNSVLVSLRSDQMTLQDAKVLLEAALRQESGARGHVSSHSHSALHAPGTPVREGLRSHLDPRTPPLPPRERPHTSGHHGAGEARATAPSTVSPYGPEARAELSSRLTTLRNTLAPATNDPRYLQACGGEKLNRFRDIQCCRQTAVRADLNANYIQVGNTRTIACQYPLQSQLESHFRMLAENRTPVLAVLASSSEIANQRFGMPDYFRQSGTYGSITVESKMTQQVGLGDGIMADMYTLTIREAGQKTISVPVVHVGNWPDQTAVSSEVTKALASLVDQTAETKRNMYESKGSSAVGDDSKLRPVIHCRAGVGRTAQLIGAMCMNDSRNSQLSVEDMVSQMRVQRNGIMVQKDEQLDVLIKLAEGQGRPLLNS
  
Inhibitor
Name:
BDBM50170985
Synonyms:
(S)-4-[(S)-4-(R)-Carbamoyl-1-(4-carboxymethoxy-benzyl)-6-methyl-2-oxo-heptylcarbamoyl]-4-[2-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-acetylamino]-butyric acid benzyl ester | CHEMBL365312
Type:
Small organic molecule
Emp. Form.:
C37H45N5O11
Mol. Mass.:
735.7801
SMILES:
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)Cn1cc(C)c(=O)[nH]c1=O)C(N)=O
Structure:
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