BDBM50619251 CHEMBL5400898

SMILES [H][C@]12CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)CNC(C)=O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@](C)(C\C=C\C[C@](C)(NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(N)=O)NC1=O)C(O)=O)C(=O)N2

InChI Key InChIKey=WAPDMCSPDAMQRT-UHFFFAOYSA-N

Data  2 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50619251   

TargetSpike glycoprotein(2019-nCoV)
Kansas State University

Curated by ChEMBL
LigandPNGBDBM50619251(CHEMBL5400898)
Affinity DataKd:  570nMAssay Description:Binding affinity to biotinylated recombinant SARS-CoV-2 spike protein RBD assessed as dissociation constant measured after 240 secs by biolayer inter...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/14/2024
Entry Details
PubMed
TargetSpike glycoprotein(2019-nCoV)
Kansas State University

Curated by ChEMBL
LigandPNGBDBM50619251(CHEMBL5400898)
Affinity DataKd:  4.10E+3nMAssay Description:Binding affinity to his tagged recombinant SARS-CoV-2 B1.617.2 (Delta) spike protein assessed as dissociation constant measured after 240 secs by bio...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/14/2024
Entry Details
PubMed