BDBM714728 1-(4-(5-(3-amino)-6-(1,1-dioxo-2,3-dihydrobenzo[b]thiophen-5-yl)pyrazin-2-yl)isoxazol-3-yl)benzyl)guanidine dihydrochloride 27::US20250026742, Example 27

SMILES N=C(N)NCc1ccc(-c2cc(-c3nc(-c4ccc5c(c4)CCS5(=O)=O)cnc3N)on2)cc1

InChI Key InChIKey=XZHKZZNHJLYEGT-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 714728   

TargetSerine/threonine-protein kinase ATR(Human)
Suzhou Ark Biopharmaceutical Co.

US Patent
LigandPNGBDBM714728(1-(4-(5-(3-amino)-6-(1,1-dioxo-2,3-dihydrobenzo[b]...)
Affinity DataIC50: 0.75nMAssay Description:Prepare various buffer systems required for the experiment:1. Prepare ATR reaction buffer containing 25 mM HEPES (Gibco, Cat #15630-080), 5 mM DTT (S...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
5/30/2025
Entry Details
Go to US Patent