Reaction Details Report a problem with these data
Target
H2-K region expressed gene 2, rat orthologue
Ligand
BDBM50079828
Substrate
n/a
Meas. Tech.
ChEBML_103872
IC50
1200±n/a nM
Citation
Jones, AB; Acton, JJ; Rivetna, MN; Cummings, RT; Cubbon, RM; Nichols, EA; Schwartz, CD; Wicker, LS; Hermes, JD Tetrapeptide derived inhibitors of complexation of a class II MHC: the peptide backbone is not inviolate. Bioorg Med Chem Lett 9:2109-14 (1999) [PubMed] Article
More Info.:
Target
Name:
H2-K region expressed gene 2, rat orthologue
Synonyms:
MHC class II | MHC class II region expressed gene KE2, isoform CRA_a
Type:
PROTEIN
Mol. Mass.:
14499.39
Organism:
Rattus norvegicus
Description:
ChEMBL_10342
Residue:
127
Sequence:
MAELIQKKLQGEVEKYQQLQKDLSKSMSGRQKLEAQLTENNIVKEELALLDGSNVVFKLLGPVLVKQELGEARATVGKRLDYITAEIKRYESQLRDLERQSEQQRETLAQLQQEFQRAQNAKAPGKA
Inhibitor
Name:
BDBM50079828
Synonyms:
CHEMBL63933 | [(S)-1-(1-{(S)-1-[((S)-(S)-1-Carbamoyl-3-methyl-butylamino)-methyl]-butylcarbamoyl}-4-guanidino-butylcarbamoyl)-2-phenyl-ethyl]-carbamic acid ethyl ester
Type:
Small organic molecule
Emp. Form.:
C29H50N8O5
Mol. Mass.:
590.7579
SMILES:
CCC[C@@H](CN[C@@H](CC(C)C)C(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCC