BDBM50254202 2-((3S,6R,11R,14R,20S,28aS)-11-amino-3-(2-amino-2-oxoethyl)-6-carbamoyl-27-hydroxy-20-isobutyl-1,4,12,15,18,21,24-heptaoxohexacosahydropyrrolo[2,1-j][1,2,5,8,11,14,17,20,23]dithiaheptaazacyclohexacosin-14-yl)acetic acid::CHEMBL2372224

SMILES [H][C@@]12C[C@@H](O)CN1C(=O)CNC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC2=O)C(N)=O

InChI Key InChIKey=FQVZXBQWOKWVKW-UHFFFAOYSA-N

Data  1 IC50  1 Kd

  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 2 hits for monomerid = 50254202   

TargetIntegrin alpha-3(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50254202(2-((3S,6R,11R,14R,20S,28aS)-11-amino-3-(2-amino-2-...)
Affinity DataIC50: 550nMAssay Description:Binding affinity to integrin alpha3 expressed in human MDA-MB-231 cells by flow cytometryMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetIntegrin alpha-3(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50254202(2-((3S,6R,11R,14R,20S,28aS)-11-amino-3-(2-amino-2-...)
Affinity DataKd:  400nMAssay Description:Binding affinity to integrin alpha3beta1 expressed in human MDA-MB-231 cells by flow cytometryMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed