BDBM490801 (4S,6R,7S,11aR,13R,14R,14aR,15R)-6,13-bis(6-amino-9H-purin-9-yl)-14-fluoro-2,9,15-trihydroxyoctahydro-11H-4,7-methanofuro[3,2-d][1,3,7,9]tetraoxa[2,8]diphosphacyclotridecine 2,9-dioxide::US10968242, Example 23
SMILES: Nc1ncnc2n(cnc12)[C@@H]1C[C@@H]2OP(O)(=O)O[C@@H]3[C@@H](COP(O)(=O)O[C@@H]1[C@@H]2O)O[C@H]([C@@H]3F)n1cnc2c(N)ncnc12
InChI Key: InChIKey=INFADFJFWHAZMS-DVLVWKEZSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Stimulator of interferon genes protein (Human) | BDBM490801 ((4S,6R,7S,11aR,13R,14R,14aR,15R)-6,13-bis(6-amino-...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | 1.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc. US Patent | Assay Description A radioligand binding assay was developed to determine compound interactions were competitive with a tritium-labeled version of the native STING liga... | US Patent US10968242 (2021) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Stimulator of interferon genes protein [H232R] (Homo sapiens (Human)) | BDBM490801 ((4S,6R,7S,11aR,13R,14R,14aR,15R)-6,13-bis(6-amino-...) | PDB Reactome pathway KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | n/a | n/a | n/a | 5.05E+3 | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc. US Patent | Assay Description Surface plasmon resonance (SPR) STING agonist binding studies were carried out using a Biacore T200 instrument (GE Healthcare) at 4° C. in a 150 mM K... | US Patent US10968242 (2021) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Stimulator of interferon genes protein (Human) | BDBM490801 ((4S,6R,7S,11aR,13R,14R,14aR,15R)-6,13-bis(6-amino-...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | n/a | n/a | n/a | 993 | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc. US Patent | Assay Description Surface plasmon resonance (SPR) STING agonist binding studies were carried out using a Biacore T200 instrument (GE Healthcare) at 4° C. in a 150 mM K... | US Patent US10968242 (2021) | |||||||||||
More data for this Ligand-Target Pair |