BDBM50175972 Bz-Nle-Lys-Arg-(p-Cl)Phe-H::CHEMBL199531

SMILES: [#6]-[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(Cl)cc1)-[#6]=O

InChI Key: InChIKey=URERCOCKBKEXMD-DZUOILHNSA-N

Data: 1 KI

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 1 hit for monomerid = 50175972   

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
Dengue virus type 2 NS3 protein (Dengue virus 2)	BDBM50175972 (Bz-Nle-Lys-Arg-(p-Cl)Phe-H | CHEMBL199531) Show SMILES [#6]-[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(Cl)cc1)-[#6]=O Show InChI InChI=1S/C34H49ClN8O5/c1-2-3-12-27(41-30(45)24-10-5-4-6-11-24)32(47)42-28(13-7-8-19-36)33(48)43-29(14-9-20-39-34(37)38)31(46)40-26(22-44)21-23-15-17-25(35)18-16-23/h4-6,10-11,15-18,22,26-29H,2-3,7-9,12-14,19-21,36H2,1H3,(H,40,46)(H,41,45)(H,42,47)(H,43,48)(H4,37,38,39)/t26-,27-,28-,29-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.38E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibitory activity against dengue 2 NS3 protease fused via a linker to region of NS2B				Bioorg Med Chem Lett 16: 40-3 (2005) Article DOI: 10.1016/j.bmcl.2005.09.049 BindingDB Entry DOI: 10.7270/Q2J965X4
					More data for this Ligand-Target Pair