BDBM586121 US11530244, Compound 038

SMILES CCC[C@@H]1NC(=O)CCSCc2cccc(CSC[C@H](NC(=O)[C@@H]3CCCN3C(=O)[C@H](Cc3ccc(OC)cc3)NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@H](Cc3cn(C)c4ccccc34)N(C)C(=O)[C@H](Cc3ccc4ccccc4c3)NC(=O)[C@@H](CC(C)C)N(C)C1=O)[C@@H](C)OC)C(N)=O)c2

InChI Key InChIKey=ISQOVBPPZKQLLB-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 586121   

LigandPNGBDBM586121(US11530244, Compound 038)
Affinity DataIC50: 50nMAssay Description:A set of cyclic polypeptides were identified to inhibit the interaction between human PCSK9 and human LDLR. Each polypeptide has an N-terminal amino ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2023
Entry Details
Go to US Patent

LigandPNGBDBM586121(US11530244, Compound 038)
Affinity DataIC50: 50nMAssay Description:The PCSK9 Alexa FRET Standard assay measured the interaction between PCSK9 and an AlexaFluor647 (AF) tagged cyclic peptide, Reagent A (KD=83 nM). A s...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/17/2023
Entry Details
Go to US Patent