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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Genome polyprotein' and Ligand = 'BDBM50110143'   
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


(Hepatitis C virus (HCV))		BDBM50110143
PNG
(4-{(S)-1-[(S)-1-((S)-3,3-Difluoro-1-oxalyl-propylc...)
Show SMILES CCC(C)[C@H](NC(=O)OCc1ccc(cc1)C(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(F)F)C(=O)C(O)=O
Show InChI InChI=1S/C26H35F2N3O9/c1-5-14(4)20(31-26(39)40-12-15-6-8-16(9-7-15)24(35)36)23(34)30-18(10-13(2)3)22(33)29-17(11-19(27)28)21(32)25(37)38/h6-9,13-14,17-20H,5,10-12H2,1-4H3,(H,29,33)(H,30,34)(H,31,39)(H,35,36)(H,37,38)/t14?,17-,18-,20-/m0/s1
PDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 440n/an/an/an/an/an/a



IRBM, MRL Rome

Curated by ChEMBL


Assay Description
Inhibition to hepatitis C virus (HCV) NS3/NS4A serine protease

Bioorg Med Chem Lett 12: 705-8 (2002)


BindingDB Entry DOI: 10.7270/Q24X572V
More data for this
Ligand-Target Pair