Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Genome polyprotein' and Ligand = 'BDBM50452537'   

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)	BDBM50452537 (CHEMBL4212654) Show SMILES COc1ccc2cc(ccc2c1)[C@@]1(C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC(C)(C)C(F)(F)F)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C1CC1)C(=O)NS(=O)(=O)C1CC1)OC |r| Show InChI InChI=1S/C38H49F3N4O9S/c1-34(2,3)29(42-33(49)54-35(4,5)38(39,40)41)31(47)45-20-36(53-7,24-12-10-23-17-25(52-6)13-11-22(23)16-24)19-28(45)30(46)43-37(18-27(37)21-8-9-21)32(48)44-55(50,51)26-14-15-26/h10-13,16-17,21,26-29H,8-9,14-15,18-20H2,1-7H3,(H,42,49)(H,43,46)(H,44,48)/t27-,28-,29+,36-,37+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	320	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Inhibition of HCV genotype 1a H77 NS3 protease infected in human HuH7 replicon cells assessed as reduction in viral replication after 4 days by lucif...				Bioorg Med Chem Lett 28: 43-48 (2018) Article DOI: 10.1016/j.bmcl.2017.11.005 BindingDB Entry DOI: 10.7270/Q2KP84RB
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus)	BDBM50452537 (CHEMBL4212654) Show SMILES COc1ccc2cc(ccc2c1)[C@@]1(C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC(C)(C)C(F)(F)F)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C1CC1)C(=O)NS(=O)(=O)C1CC1)OC |r| Show InChI InChI=1S/C38H49F3N4O9S/c1-34(2,3)29(42-33(49)54-35(4,5)38(39,40)41)31(47)45-20-36(53-7,24-12-10-23-17-25(52-6)13-11-22(23)16-24)19-28(45)30(46)43-37(18-27(37)21-8-9-21)32(48)44-55(50,51)26-14-15-26/h10-13,16-17,21,26-29H,8-9,14-15,18-20H2,1-7H3,(H,42,49)(H,43,46)(H,44,48)/t27-,28-,29+,36-,37+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	302	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Inhibition of HCV genotype 1b Con1 NS3 protease infected in human HuH7 replicon cells assessed as reduction in viral replication after 4 days by luci...				Bioorg Med Chem Lett 28: 43-48 (2018) Article DOI: 10.1016/j.bmcl.2017.11.005 BindingDB Entry DOI: 10.7270/Q2KP84RB
					More data for this Ligand-Target Pair