BDBM448349 Perampanel, 5
SMILES: CCCOc1cc(Cl)cc(c1)C1C=C(C(=O)N(C1=O)c1cccnc1)c1ccccc1C#N
InChI Key: InChIKey=OWQNFRYCFVOJPQ-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Replicase polyprotein 1ab (2019-nCoV) | BDBM448349![]() (Perampanel, 5) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | Article | n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Yale University | Assay Description Inhibition of proteolytic activity was tested using recombinant SARS-CoV-2Mpro, which was expressed and purified as previously described.8,12 For the... | ACS Cent Sci (2021) Article DOI: 10.1021/acscentsci.1c00039 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Replicase polyprotein 1ab (2019-nCoV) | BDBM448349![]() (Perampanel, 5) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | Article | n/a | n/a | n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a |
Yale University | Assay Description Vero-E6 cells were seeded at 4 x 10E5 cells/well in 12-well plates and infected for 1 hour with the SARS-CoV-2 isolate USA-WA1/2020 at an MOI of 0.01... | ACS Cent Sci (2021) Article DOI: 10.1021/acscentsci.1c00039 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Replicase polyprotein 1ab (2019-nCoV) | BDBM448349![]() (Perampanel, 5) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | Article | n/a | n/a | n/a | n/a | 2.50E+3 | n/a | n/a | n/a | n/a |
Yale University | Assay Description The antiviral activity of compounds was examined by evaluating the cytopathic effect in Vero-E6 cells grown at 37°C in a 5% CO2 atmosphere for 72 h u... | ACS Cent Sci (2021) Article DOI: 10.1021/acscentsci.1c00039 | |||||||||||
More data for this Ligand-Target Pair |