BDBM55039 1-(6-methylpyridin-2-yl)-4-oxidanyl-2-(3-phenoxyphenyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one::3-Hydroxy-1-(6-methyl-pyridin-2-yl)-5-(3-phenoxy-phenyl)-4-(thiophene-2-carbonyl)-1,5-dihydro-pyrrol-2- one::3-hydroxy-1-(6-methyl-2-pyridyl)-5-(3-phenoxyphenyl)-4-(2-thenoyl)-3-pyrrolin-2-one::4-hydroxy-1-(6-methyl-2-pyridinyl)-3-[oxo(thiophen-2-yl)methyl]-2-(3-phenoxyphenyl)-2H-pyrrol-5-one::4-hydroxy-1-(6-methylpyridin-2-yl)-2-(3-phenoxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one::MLS001029613::SMR000425062::cid_3303130
SMILES: Cc1cccc(n1)N1C(C(C(=O)c2cccs2)C(=O)C1=O)c1cccc(Oc2ccccc2)c1
InChI Key: InChIKey=FXFPFNOMFHNZPP-UHFFFAOYSA-N
Data: 1 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
NS3 (Hepatitis C virus) | BDBM55039 (1-(6-methylpyridin-2-yl)-4-oxidanyl-2-(3-phenoxyph...) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 3.02E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2XS5ST3 | |||||||||||
More data for this Ligand-Target Pair |