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Target
Chitotriosidase-1
Ligand
BDBM601671
Substrate
n/a
Meas. Tech.
AMCase Activity Assay
IC50
<100±n/a nM
Citation
 Mazur, M; Andryianau, G; Joachimiak, L; Czestkowski, W; Kowalski, M; Niedziejko, P; Olejniczak, S; Matyszewski, K; Koralewski, R; Olczak, J; Golebiowski, A; Bartoszewicz, A Substituted amino triazoles useful as chitinase inhibitors US Patent  US11638707 Publication Date 5/2/2023 
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:
BDBM601671
Synonyms:
US11638707, Example 76.
Type:
Small organic molecule
Emp. Form.:
C19H26BrFN6O
Mol. Mass.:
453.352
SMILES:
Nc1nnc([nH]1)N1CCC(CC1)N1C[C@H](CF)OC[C@@H]1Cc1ccc(Br)cc1 |r|
Structure:
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