BDBM50626231 CHEMBL5435264

SMILES CCC[C@@H](CCO)Nc1c2c(cnn2Cc3c(cc(cn3)C4CCN(CC4)C5CCOCC5)OC)nc(n1)N

InChI Key InChIKey=RZRJLAWKPZNKQG-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
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 3 hits for monomerid = 50626231   

TargetToll-like receptor 7(Human)
Bristol Myers Squibb

Curated by ChEMBL
LigandPNGBDBM50626231(CHEMBL5435264)
Affinity DataEC50:  13nMAssay Description:Agonist activity at human TLR7 in HEK-Blue hTLR7 cells harboring SEAP reporter transgene incubated for 18 hrs by quanti-blue reagent based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/18/2024
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetToll-like receptor 7(Mouse)
Bristol Myers Squibb

Curated by ChEMBL
LigandPNGBDBM50626231(CHEMBL5435264)
Affinity DataEC50:  27nMAssay Description:Agonist activity at mouse TLR7More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/18/2024
Entry Details
PubMed
TargetToll-like receptor 8(Human)
Bristol Myers Squibb

Curated by ChEMBL
LigandPNGBDBM50626231(CHEMBL5435264)
Affinity DataEC50: >5.00E+3nMAssay Description:Agonist activity at human TLR8More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/18/2024
Entry Details
PubMed