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Target
HLA class II histocompatibility antigen, DR beta 3 chain
Ligand
BDBM50287626
Substrate
n/a
Meas. Tech.
ChEBML_47860
IC50
180±n/a nM
Citation
 Hanson, GJ; Vuletich, JL; Bedell, LJ; Bono, CP; Howard, SC; Welply, JK; Woulfe, SL; Zacheis, ML Design of MHC class II (DR4) ligands using conformationally restricted imino acids at p3 and p5 Bioorg Med Chem Lett 6:1931-1936 (1996)    Article 
Target
Name:
HLA class II histocompatibility antigen, DR beta 3 chain
Synonyms:
DRB3_HUMAN | HLA class II histocompatibility antigen DRB3-1 | HLA class II histocompatibility antigen, DRB3-1 beta chain | HLA-DRB3 | Human leukocyte antigen DR beta chain | MHC class I antigen DRB3*1
Type:
PROTEIN
Mol. Mass.:
29969.73
Organism:
Homo sapiens (Human)
Description:
ChEMBL_47860
Residue:
266
Sequence:
MVCLKLPGGSSLAALTVTLMVLSSRLAFAGDTRPRFLELRKSECHFFNGTERVRYLDRYFHNQEEFLRFDSDVGEYRAVTELGRPVAESWNSQKDLLEQKRGRVDNYCRHNYGVGESFTVQRRVHPQVTVYPAKTQPLQHHNLLVCSVSGFYPGSIEVRWFRNGQEEKAGVVSTGLIQNGDWTFQTLVMLETVPRSGEVYTCQVEHPSVTSALTVEWRARSESAQSKMLSGVGGFVLGLLFLGAGLFIYFRNQKGHSGLQPTGFLS
  
Inhibitor
Name:
BDBM50287626
Synonyms:
(S)-2-((2S,3R)-2-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-Acetylamino-3-(4-hydroxy-phenyl)-propionylamino]-5-guanidino-pentanoylamino}-propionylamino)-4-methylsulfanyl-butyrylamino]-propionylamino}-3-hydroxy-butyrylamino)-4-methyl-pentanoic acid amide | CHEMBL291311
Type:
Small organic molecule
Emp. Form.:
C38H63N11O10S
Mol. Mass.:
866.04
SMILES:
CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(N)=O
Structure:
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