BDBM50635296 CHEMBL5512498

SMILES c1nc2c3c(n1)n(cn3)[C@H]4[C@@H]([C@H]5[C@H](O4)CO[P@](=O)(O[C@@H]6[C@@H](CO[P@@](=O)(O5)S)O[C@H]([C@@H]6F)n7cnc8c7ncnc8NC/C=C/CN2)S)F

InChI Key InChIKey=YQSAUMRQALUWNS-UHFFFAOYSA-N

PDB links: 2 PDB IDs match this monomer.

  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 5 hits for monomerid = 50635296   

TargetStimulator of interferon genes protein(Human)
Gachon University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50635296BDBM50635296(CHEMBL5512498)
Affinity DataKd:  40nMAssay Description:Binding affinity to recombinant human wild type STING expressed in Escherichia coli BL21 DE3 assessed as dissociation constant by Surface plasmon res...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetStimulator of interferon genes protein(Human)
Gachon University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50635296BDBM50635296(CHEMBL5512498)
Affinity DataEC50:  1.00E+3nMAssay Description:Agonist activity at human wild type STING expressed in human THP-1 cells assessed increase in IRF3 phosphorylation incubated for 6 hrs by Western blo...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetStimulator of interferon genes protein(Human)
Gachon University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50635296BDBM50635296(CHEMBL5512498)
Affinity DataEC50:  1.20E+3nMAssay Description:Agonist activity at human STING AQ variant expressed in human THP-1 cells expressing IRF inducible SEAP reporter construct assessed as increase in in...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetStimulator of interferon genes protein(Human)
Gachon University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50635296BDBM50635296(CHEMBL5512498)
Affinity DataEC50:  2.20E+3nMAssay Description:Agonist activity at human STING HAQ variant expressed in human THP-1 cells expressing IRF inducible SEAP reporter construct assessed as increase in i...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetStimulator of interferon genes protein(Human)
Gachon University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50635296BDBM50635296(CHEMBL5512498)
Affinity DataEC50:  4.90E+3nMAssay Description:Agonist activity at human STING REF variant expressed in human THP-1 cells expressing IRF inducible SEAP reporter construct assessed as increase in i...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMedPDB3D3D Structure (crystal)