BDBM50217432 2S,3R,5S-3-{2-[1-(3,3-dimethyl-butyryl)-5-(pyridin-2-ylaminomethyl)-pyrrolidin-3-yloxy]-acetylamino}-2-(2,4,6-trimethyl-benzoylamino)-propionic acid::CHEMBL412400

SMILES Cc1cc(C)c(C(=O)N[C@@H](CNC(=O)CO[C@@H]2C[C@@H](CNc3ccccn3)N(C2)C(=O)CC(C)(C)C)C(O)=O)c(C)c1

InChI Key InChIKey=AZJYXUVHLYXCJY-VXNXHJTFSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50217432   

TargetIntegrin alpha-V/beta-5(Human)
Jerini

Curated by ChEMBL
LigandPNGBDBM50217432(2S,3R,5S-3-{2-[1-(3,3-dimethyl-butyryl)-5-(pyridin...)
Affinity DataIC50: >5.00E+4nMAssay Description:Inhibition of integrin alphaVbeta5 receptor by ELISAMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetIntegrin alpha-V/beta-3(Human)
Jerini

Curated by ChEMBL
LigandPNGBDBM50217432(2S,3R,5S-3-{2-[1-(3,3-dimethyl-butyryl)-5-(pyridin...)
Affinity DataIC50:  1.60E+4nMAssay Description:Inhibition of integrin alphaVbeta3 receptor by ELISAMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetIntegrin alpha-5/beta-1(Human)
Jerini

Curated by ChEMBL
LigandPNGBDBM50217432(2S,3R,5S-3-{2-[1-(3,3-dimethyl-butyryl)-5-(pyridin...)
Affinity DataIC50:  1.60nMAssay Description:Inhibition of integrin alpha5beta1 receptor by ELISAMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetIntegrin alpha-IIb/beta-3(Human)
Jerini

Curated by ChEMBL
LigandPNGBDBM50217432(2S,3R,5S-3-{2-[1-(3,3-dimethyl-butyryl)-5-(pyridin...)
Affinity DataIC50: >5.00E+4nMAssay Description:Inhibition of integrin alpha2bbeta3 receptor by ELISAMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed