BDBM50559849 Gs-9688::Selgantolimod

SMILES CCCC[C@](C)(CO)Nc1c2c(cc(cn2)F)nc(n1)N

InChI Key InChIKey=HTCJUBZBSJQWBW-UHFFFAOYSA-N

Data  3 EC50

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50559849   

TargetToll-like receptor 8(Human)
Gilead Sciences

Curated by ChEMBL
LigandPNGBDBM50559849(Selgantolimod | Gs-9688)
Affinity DataEC50:  220nMAssay Description:Agonist activity at TLR8 in human cryopreserved PBMC assessed as inhibition of IL-12p40 production measured after 24 hrsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetToll-like receptor 7(Human)
Gilead Sciences

Curated by ChEMBL
LigandPNGBDBM50559849(Selgantolimod | Gs-9688)
Affinity DataEC50: >5.00E+4nMAssay Description:Agonist activity at TLR7 in human cryopreserved PBMC assessed as induction of IFNalpha production measured after 24 hrsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/28/2022
Entry Details Article
PubMed
TargetToll-like receptor 8(Human)
Gilead Sciences

Curated by ChEMBL
LigandPNGBDBM50559849(Selgantolimod | Gs-9688)
Affinity DataEC50:  220nMAssay Description:Agonist activity at TLR8 (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/16/2024
Entry Details
PubMedPDB3D3D Structure (crystal)