Reaction Details Report a problem with these data
Target
Acidic mammalian chitinase
Ligand
BDBM50453492
Substrate
n/a
Meas. Tech.
ChEMBL_1750199 (CHEMBL4184959)
IC50
527±n/a nM
Citation
  TBA Bioorg Med Chem Lett 28:310-314 (2018) [PubMed]  Article 
Target
Name:
Acidic mammalian chitinase
Synonyms:
AMCase | CHIA_MOUSE | Chia | Chia1 | YNL
Type:
PROTEIN
Mol. Mass.:
51991.60
Organism:
Mus musculus
Description:
ChEMBL_828636
Residue:
473
Sequence:
MAKLLLVTGLALLLNAQLGSAYNLICYFTNWAQYRPGLGSFKPDDINPCLCTHLIYAFAGMQNNEITTIEWNDVTLYKAFNDLKNRNSKLKTLLAIGGWNFGTAPFTTMVSTSQNRQTFITSVIKFLRQYGFDGLDLDWEYPGSRGSPPQDKHLFTVLVKEMREAFEQEAIESNRPRLMVTAAVAGGISNIQAGYEIPELSKYLDFIHVMTYDLHGSWEGYTGENSPLYKYPTETGSNAYLNVDYVMNYWKNNGAPAEKLIVGFPEYGHTFILRNPSDNGIGAPTSGDGPAGPYTRQAGFWAYYEICTFLRSGATEVWDASQEVPYAYKANEWLGYDNIKSFSVKAQWLKQNNFGGAMIWAIDLDDFTGSFCDQGKFPLTSTLNKALGISTEGCTAPDVPSEPVTTPPGSGSGGGSSGGSSGGSGFCADKADGLYPVADDRNAFWQCINGITYQQHCQAGLVFDTSCNCCNWP
  
Inhibitor
Name:
BDBM50453492
Synonyms:
CHEMBL4217181
Type:
Small organic molecule
Emp. Form.:
C21H30ClN7O2
Mol. Mass.:
447.962
SMILES:
C[C@H]1CN([C@@H](Cc2ccc(Cl)cc2)CN1CC(O)=O)C1CCN(CC1)c1n[nH]c(N)n1 |r|
Structure:
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