Reaction Details Report a problem with these data
Target
Acidic mammalian chitinase
Ligand
BDBM50453473
Substrate
n/a
Meas. Tech.
ChEMBL_1750199 (CHEMBL4184959)
IC50
136±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:
BDBM50453473
Synonyms:
CHEMBL4214400
Type:
Small organic molecule
Emp. Form.:
C21H30ClN7O
Mol. Mass.:
431.962
SMILES:
[H][C@@]12C[C@@H](O)CN1C[C@H](Cc1ccc(Cl)cc1)N(C2)C1CCN(CC1)c1n[nH]c(N)n1 |r|
Structure:
Search PDB for entries with ligand similarity: