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Target
Chitotriosidase-1
Ligand
BDBM50214361
Substrate
n/a
Meas. Tech.
ChEBML_49251
IC50
7.53±n/a nM
Citation
 Sakuda, S; Sakurada, M Preparation of biotinylated allosamidins with strong chitinase inhibitory activities. Bioorg Med Chem Lett 8:2987-90 (1998) [PubMed]  Article 
Target
Name:
Chitotriosidase-1
Synonyms:
CHIT1 | CHIT1_HUMAN | Chitinase 1 | Chitinase-1 | Chitotriosidase | Chitotriosidase-1 | Chitotriosidase-1 (CHIT1)
Type:
Enzyme
Mol. Mass.:
51682.25
Organism:
Homo sapiens (Human)
Description:
Q13231
Residue:
466
Sequence:
MVRSVAWAGFMVLLMIPWGSAAKLVCYFTNWAQYRQGEARFLPKDLDPSLCTHLIYAFAGMTNHQLSTTEWNDETLYQEFNGLKKMNPKLKTLLAIGGWNFGTQKFTDMVATANNRQTFVNSAIRFLRKYSFDGLDLDWEYPGSQGSPAVDKERFTTLVQDLANAFQQEAQTSGKERLLLSAAVPAGQTYVDAGYEVDKIAQNLDFVNLMAYDFHGSWEKVTGHNSPLYKRQEESGAAASLNVDAAVQQWLQKGTPASKLILGMPTYGRSFTLASSSDTRVGAPATGSGTPGPFTKEGGMLAYYEVCSWKGATKQRIQDQKVPYIFRDNQWVGFDDVESFKTKVSYLKQKGLGGAMVWALDLDDFAGFSCNQGRYPLIQTLRQELSLPYLPSGTPELEVPKPGQPSEPEHGPSPGQDTFCQGKADGLYPNPRERSSFYSCAAGRLFQQSCPTGLVFSNSCKCCTWN
  
Inhibitor
Name:
BDBM50214361
Synonyms:
CHEMBL415389
Type:
Small organic molecule
Emp. Form.:
C57H94N14O18S2
Mol. Mass.:
1327.569
SMILES:
[H][C@]12CSC(CCCCC(=O)NCCCCCC(=O)N\N=C\C(CO)OC(OC3C(CO)OC(OC4C(O)C5N=C(OC5C4CO)N(C)C)C(NC(C)=O)C3O)C(NC(C)=O)\C=N\NC(=O)CCCCCNC(=O)CCCCC3SC[C@]4([H])NC(=O)N[C@]34[H])[C@@]1([H])NC(=O)N2 |c:39|
Structure:
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