BDBM110375 US8613914, 147::US9206232, 147

SMILES: CC(C)N1CCCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1C[C@]2(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)N1CCCC1)C(C)(C)C21CCC1)C1(C)CCOCC1)C1(C)CCCCC1

InChI Key: InChIKey=VCYVRAYCTRSTDK-ZOEOYGBESA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 110375   

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
HCV NS3-NS4A Serine Proteinase (Hepatitis C virus (HCV genotype 1a, isolate H))	BDBM110375 (US8613914, 147 | US9206232, 147) Show SMILES CC(C)N1CCCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1C[C@]2(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)N1CCCC1)C(C)(C)C21CCC1)C1(C)CCOCC1)C1(C)CCCCC1 |r| Show InChI InChI=1S/C48H77N7O8S/c1-8-33-29-48(33,42(60)52-64(61,62)53-24-14-15-25-53)51-39(57)35-30-47(43(4,5)46(47)20-16-21-46)31-55(35)41(59)37(45(7)22-27-63-28-23-45)50-40(58)36(44(6)18-11-9-12-19-44)49-38(56)34-17-10-13-26-54(34)32(2)3/h8,32-37H,1,9-31H2,2-7H3,(H,49,56)(H,50,58)(H,51,57)(H,52,60)/t33-,34+,35+,36-,37-,47-,48-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description The inhibitory activity of certain compounds of Table A against HCV NS3-4A serine protease is determined in a homogenous assay using the full-length ...				US Patent US9206232 (2015) BindingDB Entry DOI: 10.7270/Q2M0447H
					More data for this Ligand-Target Pair
NS3/4A protein (Hepatitis C virus)	BDBM110375 (US8613914, 147 | US9206232, 147) Show SMILES CC(C)N1CCCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N1C[C@]2(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)N1CCCC1)C(C)(C)C21CCC1)C1(C)CCOCC1)C1(C)CCCCC1 |r| Show InChI InChI=1S/C48H77N7O8S/c1-8-33-29-48(33,42(60)52-64(61,62)53-24-14-15-25-53)51-39(57)35-30-47(43(4,5)46(47)20-16-21-46)31-55(35)41(59)37(45(7)22-27-63-28-23-45)50-40(58)36(44(6)18-11-9-12-19-44)49-38(56)34-17-10-13-26-54(34)32(2)3/h8,32-37H,1,9-31H2,2-7H3,(H,49,56)(H,50,58)(H,51,57)(H,52,60)/t33-,34+,35+,36-,37-,47-,48-/m1/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description The inhibitory activity of certain compounds against HCV NS3-4A serine protease is determined in a homogenous assay using the full-length NS3-4A prot...				US Patent US8613914 (2013) BindingDB Entry DOI: 10.7270/Q28C9TWW
					More data for this Ligand-Target Pair