null

SMILES: COc1ccc2cc(ccc2c1)[C@@]1(C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)OC

InChI Key: InChIKey=NPDJDVOYYRDYDC-IBDGMSGISA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50452523   

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
Genome polyprotein (Hepatitis C virus)	BDBM50452523 (CHEMBL4212349) Show SMILES COc1ccc2cc(ccc2c1)[C@@]1(C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)OC |r| Show InChI InChI=1S/C37H50N4O9S/c1-10-24-19-37(24,32(44)40-51(46,47)27-15-16-27)39-30(42)28-20-36(49-9,25-13-11-23-18-26(48-8)14-12-22(23)17-25)21-41(28)31(43)29(34(2,3)4)38-33(45)50-35(5,6)7/h10-14,17-18,24,27-29H,1,15-16,19-21H2,2-9H3,(H,38,45)(H,39,42)(H,40,44)/t24-,28+,29-,36+,37-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	55	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)	BDBM50452523 (CHEMBL4212349) Show SMILES COc1ccc2cc(ccc2c1)[C@@]1(C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)OC |r| Show InChI InChI=1S/C37H50N4O9S/c1-10-24-19-37(24,32(44)40-51(46,47)27-15-16-27)39-30(42)28-20-36(49-9,25-13-11-23-18-26(48-8)14-12-22(23)17-25)21-41(28)31(43)29(34(2,3)4)38-33(45)50-35(5,6)7/h10-14,17-18,24,27-29H,1,15-16,19-21H2,2-9H3,(H,38,45)(H,39,42)(H,40,44)/t24-,28+,29-,36+,37-/m1/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	34	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