null

SMILES: OCCNc1ccc2C(=O)N(Cc3cccc1c23)c1cccc(Br)c1

InChI Key: InChIKey=ZCMBMVCSHHULNR-UHFFFAOYSA-N

PDB links: 2 PDB IDs contain this monomer as substructures. 2 PDB IDs contain inhibitors having a similarity of 90% to this monomer.

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 = 35561   

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 genotype 2b (isolate HC-J8) (HCV...)	BDBM35561 (benzo[de]isoquinolinone, 10) Show SMILES OCCNc1ccc2C(=O)N(Cc3cccc1c23)c1cccc(Br)c1 Show InChI InChI=1S/C20H17BrN2O2/c21-14-4-2-5-15(11-14)23-12-13-3-1-6-16-18(22-9-10-24)8-7-17(19(13)16)20(23)25/h1-8,11,22,24H,9-10,12H2	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
IRBM-MRL Rome					Assay Description Primer-dependent assays were performed using the homopolymeric template/primer. Compounds, polymerase and template RNA were incubated at RT for 25 mi...				J Med Chem 52: 5217-27 (2009) Article DOI: 10.1021/jm900517t BindingDB Entry DOI: 10.7270/Q2X928P4
					More data for this Ligand-Target Pair				3D Structure (docked)
Genome polyprotein (Hepatitis C virus genotype 1b (isolate BK) (HCV))	BDBM35561 (benzo[de]isoquinolinone, 10) Show SMILES OCCNc1ccc2C(=O)N(Cc3cccc1c23)c1cccc(Br)c1 Show InChI InChI=1S/C20H17BrN2O2/c21-14-4-2-5-15(11-14)23-12-13-3-1-6-16-18(22-9-10-24)8-7-17(19(13)16)20(23)25/h1-8,11,22,24H,9-10,12H2	PDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	850	n/a	n/a	n/a	n/a	7.5	23
IRBM-MRL Rome					Assay Description Primer-dependent assays were performed using the homopolymeric template/primer. Compounds, polymerase and template RNA were incubated at RT for 25 mi...				J Med Chem 52: 5217-27 (2009) Article DOI: 10.1021/jm900517t BindingDB Entry DOI: 10.7270/Q2X928P4
					More data for this Ligand-Target Pair