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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Genome polyprotein' and Ligand = 'BDBM50522789'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Genome polyprotein


(Dengue virus 2)		BDBM50522789
PNG
(CHEMBL4474101)
Show SMILES CN([C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@](C)(C(N)=O)c1ccccc1)C(=O)c1ccccc1 |r|
Show InChI InChI=1S/C29H42N8O4/c1-29(27(31)41,21-14-7-4-8-15-21)36-24(38)22(16-9-10-18-30)35-25(39)23(17-11-19-34-28(32)33)37(2)26(40)20-12-5-3-6-13-20/h3-8,12-15,22-23H,9-11,16-19,30H2,1-2H3,(H2,31,41)(H,35,39)(H,36,38)(H4,32,33,34)/t22-,23-,29+/m0/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



Heidelberg University

Curated by ChEMBL


Assay Description
Inhibition of Dengue virus serotype 2 NS2B-NS3 protease preincubated with protein for 15 mins followed by Abz-Nle-Lys-Arg-Arg-Ser-3-(NO2)Tyr substrat...

Bioorg Med Chem Lett 29: 1913-1917 (2019)


Article DOI: 10.1016/j.bmcl.2019.05.054
BindingDB Entry DOI: 10.7270/Q2T15723
More data for this
Ligand-Target Pair