BDBM50208944 5-chloropyridin-3-yl 3-methoxybenzoate::5-chloropyridin-3-yl-3-methoxybenzoate::CHEMBL222735
SMILES: COc1cccc(c1)C(=O)Oc1cncc(Cl)c1
InChI Key: InChIKey=UIXQHURPUVBNCZ-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3C-like proteinase (3CL-PRO) (Human SARS coronavirus (SARS-CoV) (Severe acute re...) | BDBM50208944 (5-chloropyridin-3-yl 3-methoxybenzoate | 5-chlorop...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Papain-like protease (PLpro) (Human SARS coronavirus (SARS-CoV)) | BDBM50208944 (5-chloropyridin-3-yl 3-methoxybenzoate | 5-chlorop...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Alberta Curated by ChEMBL | Assay Description Inhibition of SARS coronavirus 3C-like protease | J Med Chem 50: 1850-64 (2007) Article DOI: 10.1021/jm061425k BindingDB Entry DOI: 10.7270/Q2RN37HR | |||||||||||
More data for this Ligand-Target Pair |