Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Replicase polyprotein 1ab' and Ligand = 'BDBM50405457'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Replicase polyprotein 1ab (2019-nCoV)	BDBM50405457 (CHEMBL5283903) Show SMILES CC(C)Cn1c2ccc3[nH]c(nc3c2c(=O)n(C)c1=O)C(C)(C)C Show InChI InChI=1S/C18H24N4O2/c1-10(2)9-22-12-8-7-11-14(20-16(19-11)18(3,4)5)13(12)15(23)21(6)17(22)24/h7-8,10H,9H2,1-6H3,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars		13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human platelet Thromboxane synthetase				Citation and Details
					More data for this Ligand-Target Pair