Reaction Details Report a problem with these data
Target
T cell receptor alpha variable 4
Ligand
BDBM96320
Substrate
n/a
IC50
76460±n/a nM
Citation
 PubChem, PC Fluorescence-based biochemical primary high throughput dose response assay to identify inhibitors of T-cell receptor (TCR)-CD3 interaction using a TAMRA-labeled TCR probe PubChem Bioassay (2013)[AID] 
Target
Name:
T cell receptor alpha variable 4
Synonyms:
TCRAV4S1 | TRAV4 | TVA4_HUMAN
Type:
Enzyme Catalytic Domain
Mol. Mass.:
12216.28
Organism:
Homo sapiens (Human)
Description:
A0A0B4J268
Residue:
109
Sequence:
MRQVARVIVFLTLSTLSLAKTTQPISMDSYEGQEVNITCSHNNIATNDYITWYQQFPSQGPRFIIQGYKTKVTNEVASLFIPADRKSSTLSLPRVSLSDTAVYYCLVGD
  
Inhibitor
Name:
BDBM96320
Synonyms:
MLS000697200 | N-[4-[5-(3,4-dimethoxyphenyl)-1,2,3-triazol-1-yl]phenyl]-4-piperidin-1-ylsulfonyl-benzamide | N-[4-[5-(3,4-dimethoxyphenyl)-1-triazolyl]phenyl]-4-(1-piperidinylsulfonyl)benzamide | N-[4-[5-(3,4-dimethoxyphenyl)triazol-1-yl]phenyl]-4-piperidin-1-ylsulfonylbenzamide | N-[4-[5-(3,4-dimethoxyphenyl)triazol-1-yl]phenyl]-4-piperidinosulfonyl-benzamide | SMR000237677 | cid_4162672
Type:
Small organic molecule
Emp. Form.:
C28H29N5O5S
Mol. Mass.:
547.625
SMILES:
COc1ccc(cc1OC)-c1cnnn1-c1ccc(NC(=O)c2ccc(cc2)S(=O)(=O)N2CCCCC2)cc1
Structure:
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