Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stimulator of interferon genes protein' and Ligand = 'BDBM50506288'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Stimulator of interferon genes protein (Human)	BDBM50506288 (CHEMBL4516920) Show SMILES CCn1nc(C)cc1C(=O)Nc1nc2cc(cc(OC)c2n1CCCNC(=O)CCC(O)=O)C(N)=O Show InChI InChI=1S/C23H29N7O6/c1-4-30-16(10-13(2)28-30)22(35)27-23-26-15-11-14(21(24)34)12-17(36-3)20(15)29(23)9-5-8-25-18(31)6-7-19(32)33/h10-12H,4-9H2,1-3H3,(H2,24,34)(H,25,31)(H,32,33)(H,26,27,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a
Peking Union Medical College and Chinese Academy of Medical Sciences Curated by ChEMBL					Assay Description Agonist activity at STING in human THP1 cells assessed as stimulation of IRF3 pathway measured after 20 hrs by luciferase reporter gene assay				J Med Chem 63: 260-282 (2020) Article DOI: 10.1021/acs.jmedchem.9b01567 BindingDB Entry DOI: 10.7270/Q2TH8R0C
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