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Target
Threonine aspartase 1
Ligand
BDBM50300920
Substrate
n/a
Meas. Tech.
ChEMBL_597942 (CHEMBL1042727)
IC50
>100000±n/a nM
Citation
 Lee, JT; Chen, DY; Yang, Z; Ramos, AD; Hsieh, JJ; Bogyo, M Design, syntheses, and evaluation of Taspase1 inhibitors. Bioorg Med Chem Lett 19:5086-90 (2009) [PubMed]  Article
Target
Name:
Threonine aspartase 1
Synonyms:
C20orf13 | TASP1 | TASP1_HUMAN
Type:
PROTEIN
Mol. Mass.:
44463.09
Organism:
Homo sapiens (Human)
Description:
ChEMBL_597942
Residue:
420
Sequence:
MTMEKGMSSGEGLPSRSSQVSAGKITAKELETKQSYKEKRGGFVLVHAGAGYHSESKAKEYKHVCKRACQKAIEKLQAGALATDAVTAALVELEDSPFTNAGMGSNLNLLGEIECDASIMDGKSLNFGAVGALSGIKNPVSVANRLLCEGQKGKLSAGRIPPCFLVGEGAYRWAVDHGIPSCPPNIMTTRFSLAAFKRNKRKLELAERVDTDFMQLKKRRQSSEKENDSGTLDTVGAVVVDHEGNVAAAVSSGGLALKHPGRVGQAALYGCGCWAENTGAHNPYSTAVSTSGCGEHLVRTILARECSHALQAEDAHQALLETMQNKFISSPFLASEDGVLGGVIVLRSCRCSAEPDSSQNKQTLLVEFLWSHTTESMCVGYMSAQDGKAKTHISRLPPGAVAGQSVAIEGGVCRLESPVN
  
Inhibitor
Name:
BDBM50300920
Synonyms:
(S)-2-((S)-2-{(S)-2-[(S)-2-((2S,3S)-2-Acetylamino-3-methyl-pentanoylamino)-3-hydroxy-propionylamino]-4-carbamoyl-butyrylamino}-4-methyl-pentanoylamino)-5-methanesulfonyl-pent-4-enoic acid | CHEMBL576100
Type:
Small organic molecule
Emp. Form.:
C28H48N6O11S
Mol. Mass.:
676.779
SMILES:
CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C\C=C\S(C)(=O)=O)C(O)=O |r|
Structure:
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