BDBM50079824 ((S)-1-{(S)-1-[(S)-(S)-1-(1-Carbamoyl-3-methyl-butylcarbamoyl)-butylcarbamoyl]-4-guanidino-butylcarbamoyl}-2-phenyl-ethyl)-carbamic acid ethyl ester::((S)-1-{(S)-1-[(S)-1-((S)-1-Carbamoyl-3-methyl-butylcarbamoyl)-butylcarbamoyl]-4-guanidino-butylcarbamoyl}-2-phenyl-ethyl)-carbamic acid ethyl ester::CHEMBL292340

SMILES CCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCC)C(=O)N[C@@H](CC(C)C)C(N)=O

InChI Key InChIKey=BYJYKJYYOSDFFJ-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50079824   

TargetMHC class II antigen(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50079824(((S)-1-{(S)-1-[(S)-(S)-1-(1-Carbamoyl-3-methyl-but...)
Affinity DataIC50: 1.40nMAssay Description:Inhibitory concentration to inhibit the binding of biotinylated rat myelin basic protein peptide (RMBP90-102) against DR1 allele of class II MHC for ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2010
Entry Details Article

TargetH2-K region expressed gene 2, rat orthologue(Rat)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50079824(((S)-1-{(S)-1-[(S)-(S)-1-(1-Carbamoyl-3-methyl-but...)
Affinity DataIC50: 1nMAssay Description:Ability to inhibit binding of biotinylated rat myelin basic protein 13-mer peptide (RMBP 90-102, Major histocompatibility complex class II to purifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMHC class II antigen(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50079824(((S)-1-{(S)-1-[(S)-(S)-1-(1-Carbamoyl-3-methyl-but...)
Affinity DataIC50: 17nMAssay Description:Inhibitory concentration required to inhibit the binding of biotinylated rat myelin basic protein peptide (RMBP90-102) against DR1 allele of class II...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2010
Entry Details Article