BDBM50594889 CHEMBL5175568

SMILES CCc1ncc(s1)S(=O)(=O)Nc1cc(cnc1OCCCN(C)C)-c1ccc2ncc3N(C)C(=O)C4(CCC4)c3c2c1

InChI Key InChIKey=UNETUVMFOUXHNZ-UHFFFAOYSA-N

Data  2 IC50

  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 3 hits for monomerid = 50594889   

TargetDNA-dependent protein kinase catalytic subunit(Human)
Xrad Therapeutics

US Patent
LigandPNGBDBM50594889(CHEMBL5175568 | US12187742, Example 245)
Affinity DataIC50: 0.5nMAssay Description:On day one, coat 96-well plate (ThermoFisher. Cat #: 442404) with GST-p53 (1-101) peptide (purified by Pharmaron, BCS department) by diluting 3 μg of...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/20/2025
Entry Details
US Patent

TargetSerine-protein kinase ATM(Human)
Hubei Polytechnic University

Curated by ChEMBL
LigandPNGBDBM50594889(CHEMBL5175568 | US12187742, Example 245)
Affinity DataIC50: 1nMAssay Description:Inhibition of ATM in human MCF7 cells using etoposide as substrate incubated for 1 hr by Cell Western assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed
TargetDNA-dependent protein kinase catalytic subunit(Human)
Xrad Therapeutics

US Patent
LigandPNGBDBM50594889(CHEMBL5175568 | US12187742, Example 245)
Affinity DataIC50: 1nMAssay Description:Inhibition of full-length human DNA-PK expressed in baculovirus expression system using p53 as substrate incubated for 1 hr in presence of ATP by ELI...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2023
Entry Details
PubMed