BDBM50509401 CHEMBL4449584

SMILES c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@H]4[C@H](O3)COP(=O)(O[C@@H]5[C@@H](COP(=O)(O4)O)O[C@H]([C@@H]5O)n6cnc7c6N=C(NC7=O)N)O)O)N

InChI Key InChIKey=RFCBNSCSPXMEBK-UHFFFAOYSA-N

Data  2 Kd  17 EC50

PDB links: 15 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 19 hits for monomerid = 50509401   

TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  5.85E+4nMAssay Description:Activation of wild-type human STING expressed in digitonin treated human THP1-Dual cells co-expressing IRF3-activated ISRE assessed as IRF3 reporter ...More data for this Ligand-Target Pair

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Date in BDB:
3/5/2023
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  2.93E+4nMMore data for this Ligand-Target Pair

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Date in BDB:
10/13/2025
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  2.06E+3nMMore data for this Ligand-Target Pair

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Date in BDB:
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  260nMMore data for this Ligand-Target Pair

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Date in BDB:
10/13/2025
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  120nMMore data for this Ligand-Target Pair

Target InfoPDBKEGG
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Date in BDB:
10/13/2025
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  120nMMore data for this Ligand-Target Pair

Target InfoPDBKEGG
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Date in BDB:
10/13/2025
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  6.84E+4nMAssay Description:Agonist activity at human wild type full length STING expressed in 293T cells incubated for 7 hrs by luciferase/cell based assayMore data for this Ligand-Target Pair

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Date in BDB:
6/19/2023
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  121nMAssay Description:Agonist activity at human wild type STING expressed in 293T cells by digitonin cell based assayMore data for this Ligand-Target Pair

Target InfoPDBKEGG
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Date in BDB:
6/19/2023
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataKd:  1.04E+3nMAssay Description:Agonist activity at wild type human STING C-terminal domain (139 to 379 residues) assessed as dissociation constant by isothermal titration calorimet...More data for this Ligand-Target Pair

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Date in BDB:
6/20/2023
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  4.74E+3nMAssay Description:Activation of wild-type human STING expressed in human THP1-Dual cells co-expressing IRF3-activated ISRE assessed as IRF3 reporter activation measure...More data for this Ligand-Target Pair

Target InfoPDBKEGG
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Date in BDB:
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  7.01E+4nMAssay Description:Activation of recombinant human wild-type STING expressed in 293T cells incubated for 7 hrs in absence of digitonin A by bright Glo-luciferase report...More data for this Ligand-Target Pair

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Date in BDB:
2/19/2021
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  1.01E+5nMAssay Description:Activation of wild-type human STING expressed in HEK293T cells co-expressing IRF3-activated ISRE assessed as IRF3 reporter activation measured after ...More data for this Ligand-Target Pair

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Date in BDB:
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50: >3.00E+5nMAssay Description:Activation of wild-type human STING expressed in HEK293T cells co-expressing IRF3-activated ISRE assessed as IRF3 reporter activation measured after ...More data for this Ligand-Target Pair

Target InfoPDBKEGG
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Date in BDB:
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  120nMAssay Description:Activation of wild-type human STING expressed in digitonin treated HEK293T cells co-expressing IRF3-activated ISRE assessed as IRF3 reporter activati...More data for this Ligand-Target Pair

Target InfoPDBKEGG
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Ligand InfoPurchaseChEBI
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Date in BDB:
3/5/2023
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataKd:  1.04E+3nMAssay Description:Binding affinity to wild type human STING (139 to 379 residues) by ITC assayMore data for this Ligand-Target Pair

Target InfoPDBKEGG
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Date in BDB:
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  120nMAssay Description:Activation of recombinant human STING haplotype R71H/G230A/R293Q mutant expressed in 293T cells measured after 30 mins in presence of digitonin A by ...More data for this Ligand-Target Pair

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Date in BDB:
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  120nMAssay Description:Activation of recombinant human wild-type STING expressed in 293T cells measured after 30 mins in presence of digitonin A by bright Glo-luciferase re...More data for this Ligand-Target Pair

Target InfoPDBKEGG
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Ligand InfoPurchaseChEBI
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Date in BDB:
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  2.06E+3nMAssay Description:Activation of recombinant human STING haplotype R293Q mutant expressed in 293T cells measured after 30 mins in presence of digitonin A by bright Glo-...More data for this Ligand-Target Pair

Target InfoPDBKEGG
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Ligand InfoPurchaseChEBI
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Date in BDB:
2/19/2021
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TargetStimulator of interferon genes protein(Human)
Institute of Organic Chemistry and Biochemistry of The Czech Academy of Sciences

Curated by ChEMBL

LigandBDBM50509401(CHEMBL4449584)Copy SMILESCopy InChI

Affinity DataEC50:  260nMAssay Description:Activation of recombinant human STING haplotype G230A/R293Q mutant expressed in 293T cells measured after 30 mins in presence of digitonin A by brigh...More data for this Ligand-Target Pair

Target InfoPDBKEGG
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Ligand InfoPurchaseChEBI
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Date in BDB:
2/19/2021
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Copy Entry DOIPubMedPDB3D Structure (crystal)
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