BDBM50274118 CHEMBL4127030::US10793591, Compound 7a
SMILES: C[C@@]1(O)[C@H](O)[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O
InChI Key: InChIKey=YEFGXGBFIOVTEX-MVHNUAHISA-N
Data: 4 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Nonstructural protein 5 (Dengue virus) | BDBM50274118 (CHEMBL4127030 | US10793591, Compound 7a) | PDB UniProtKB/TrEMBL GoogleScholar AffyNet | KEGG PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for Tropical Diseases Curated by ChEMBL | Assay Description Inhibition of Dengue virus RdRp activity using 5'-(TCAG)20(TCCAAG)14(TCAG)20-3' as template measured after 120 mins | Bioorg Med Chem Lett 28: 2324-2327 (2018) Article DOI: 10.1016/j.bmcl.2018.04.069 BindingDB Entry DOI: 10.7270/Q24T6MWH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
RNA-directed RNA polymerase (NS5B) (Hepatitis C virus genotype 1b (isolate Con1) (HCV)) | BDBM50274118 (CHEMBL4127030 | US10793591, Compound 7a) | MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet | KEGG PC cid PC sid UniChem Similars | US Patent | n/a | n/a | <1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Janssen BioPharma, Inc. US Patent | Assay Description The enzyme activity of NS5B570-Con1 (Delta-21) was measured as an incorporation of tritiated NMP into acid-insoluble RNA products. The complementary ... | US Patent US10793591 (2020) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
RNA-directed RNA polymerase (NS5B) (Hepatitis C virus genotype 1b (isolate Con1) (HCV)) | BDBM50274118 (CHEMBL4127030 | US10793591, Compound 7a) | MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet | KEGG PC cid PC sid UniChem Similars | US Patent | n/a | n/a | <1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Janssen BioPharma, Inc. US Patent | Assay Description The enzyme activity of NS5B570-Con1 (Delta-21) was measured as an incorporation of tritiated NMP into acid-insoluble RNA products. The complementary ... | US Patent US10793591 (2020) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Hepatitis C virus NS5B RNA-dependent RNA polymerase (Hepatitis C virus) | BDBM50274118 (CHEMBL4127030 | US10793591, Compound 7a) | UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | KEGG PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Janssen BioPharma, Inc. Curated by ChEMBL | Assay Description Inhibition of HCV NS5B RNA-dependent RNA polymerase activity assessed as reduction in radiolabeled-UTP incorporation into RNA using cIRES template me... | J Med Chem 62: 4555-4570 (2019) Article DOI: 10.1021/acs.jmedchem.9b00143 | |||||||||||
More data for this Ligand-Target Pair |