BDBM50287653 1-[(S)-2-((R)-3-Cyclohexyl-butyrylamino)-3-methyl-butyryl]-piperidine-2-carboxylic acid {1-[(S)-2-((1S,2R)-2-hydroxy-1-propylcarbamoyl-propylcarbamoyl)-pyrrolidine-1-carbonyl]-but-3-ynyl}-amide::CHEMBL2373023

SMILES CCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC#C)NC(=O)[C@@H]1CCCCN1C(=O)[C@@H](NC(=O)C[C@H](C)C1CCCCC1)C(C)C)[C@@H](C)O

InChI Key InChIKey=QAYVHPIPEZWKFC-OLWNUNNSSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50287653   

TargetHLA class II histocompatibility antigen, DR beta 3 chain(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50287653(1-[(S)-2-((R)-3-Cyclohexyl-butyrylamino)-3-methyl-...)
Affinity DataIC50:  4.37E+4nMAssay Description:Ability to compete for binding to Class II MHC using ELISA assay.More data for this Ligand-Target Pair
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