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Target
Lymphocyte antigen 96
Ligand
BDBM50277588
Substrate
n/a
Meas. Tech.
ChEMBL_1718219 (CHEMBL4133219)
KOFF
1.1 s-1
Citation
 Chen, G; Xiao, B; Chen, L; Bai, B; Zhang, Y; Xu, Z; Fu, L; Liu, Z; Li, X; Zhao, Y; Liang, G Discovery of new MD2-targeted anti-inflammatory compounds for the treatment of sepsis and acute lung injury. Eur J Med Chem 139:726-740 (2017) [PubMed]  Article 
Target
Name:
Lymphocyte antigen 96
Synonyms:
ESOP-1 | ESOP1 | ESOP1 | LY96 | LY96_HUMAN | Ly-96 | Lymphocyte antigen 96 | MD2 | Protein MD-2 | TLR4-MD2
Type:
PROTEIN
Mol. Mass.:
18551.39
Organism:
Homo sapiens (Human)
Description:
ChEMBL_107939
Residue:
160
Sequence:
MLPFLFFSTLFSSIFTEAQKQYWVCNSSDASISYTYCDKMQYPISINVNPCIELKRSKGLLHIFYIPRRDLKQLYFNLYITVNTMNLPKRKEVICRGSDDDYSFCRALKGETVNTTISFSFKGIKFSKGKYKCVVEAISGSPEEMLFCLEFVILHQPNSN
  
Inhibitor
Name:
BDBM50277588
Synonyms:
CHEMBL4176576
Type:
Small organic molecule
Emp. Form.:
C18H15BrO3
Mol. Mass.:
359.214
SMILES:
COc1ccccc1\C=C\C(=O)\C=C\c1ccc(O)c(Br)c1
Structure:
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