Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Genome polyprotein' and Ligand = 'BDBM486239'   

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
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486239 (US10947210, Compound 13-8C) Show SMILES CNC(=O)c1c(oc2cc(N(CCCCOCCc3ccc(cc3)C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H35FN2O7S/c1-35-32(37)30-27-19-26(22-9-10-22)28(20-29(27)43-31(30)23-11-13-25(34)14-12-23)36(44(2,40)41)16-3-4-17-42-18-15-21-5-7-24(8-6-21)33(38)39/h5-8,11-14,19-20,22H,3-4,9-10,15-18H2,1-2H3,(H,35,37)(H,38,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description The reaction mixtures consisted of 50 mM Hepes-KOH, pH 7.5, 5 mM MgCl2, 5 mM DTT, 2% glycerol, 0.01% Triton® X-100, 0.5 uM polyA:U16 substrate, purif...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus genotype 3a (isolate k3a) (HCV))	BDBM486239 (US10947210, Compound 13-8C) Show SMILES CNC(=O)c1c(oc2cc(N(CCCCOCCc3ccc(cc3)C(O)=O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H35FN2O7S/c1-35-32(37)30-27-19-26(22-9-10-22)28(20-29(27)43-31(30)23-11-13-25(34)14-12-23)36(44(2,40)41)16-3-4-17-42-18-15-21-5-7-24(8-6-21)33(38)39/h5-8,11-14,19-20,22H,3-4,9-10,15-18H2,1-2H3,(H,35,37)(H,38,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	<100	n/a	n/a	n/a	n/a
COCRYSTAL PHARMA, INC. US Patent					Assay Description HCV replicon assay is based on the luciferase reporter cell line (Huh-luc/neo-ET). This reporter cell line is a human liver carcinoma cell line (Huh-...				US Patent US10947210 (2021) BindingDB Entry DOI: 10.7270/Q2CZ3B8J
					More data for this Ligand-Target Pair