BindingDB PrimarySearch

Found 2 hits Enz. Inhib. hit(s) with all data for entry = 50016977
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Replicase polyprotein 1a (Human SARS coronavirus (SARS-CoV))	BDBM11245 (AG7088 analogue 1c \| CHEMBL194398 \| ethyl (2E,4S)-...) Show SMILES Show InChI	PDB Reactome pathway UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibitory concentration required for antiviral activity against SARS-CoV 3CLpro protease				J Med Chem 48: 6767-71 (2005) Article DOI: 10.1021/jm050548m BindingDB Entry DOI: 10.7270/Q28W3CVZ
Purdue University Curated by ChEMBL					More data for this Ligand-Target Pair
Replicase polyprotein 1a (Human SARS coronavirus (SARS-CoV))	BDBM50176014 ((S,E)-ethyl 4-((2R,5S)-6-methyl-2-(3-methylbut-2-e...) Show SMILES Show InChI	PDB Reactome pathway UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar	CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	7.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibitory concentration required for antiviral activity against SARS-CoV 3CLpro protease				J Med Chem 48: 6767-71 (2005) Article DOI: 10.1021/jm050548m BindingDB Entry DOI: 10.7270/Q28W3CVZ
Purdue University Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)