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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nonstructural protein 5A' and Ligand = 'BDBM50537573'   
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
Nonstructural protein 5A


(Hepatitis C virus)		BDBM50537573
PNG
(CHEMBL4642429)
Show SMILES OC(=O)\C=C\c1ccc(NC(=O)N(C2CCCC2)C(=O)c2ccc3n(C4CCCCC4)c(nc3c2)-c2ccccn2)cc1
Show InChI InChI=1S/C34H35N5O4/c40-31(41)20-15-23-13-17-25(18-14-23)36-34(43)39(27-10-4-5-11-27)33(42)24-16-19-30-29(22-24)37-32(28-12-6-7-21-35-28)38(30)26-8-2-1-3-9-26/h6-7,12-22,26-27H,1-5,8-11H2,(H,36,43)(H,40,41)/b20-15+
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 550n/an/an/an/an/an/a



Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 Y188L reverse transcriptase.

Eur J Med Chem 164: 576-601 (2019)


Article DOI: 10.1016/j.ejmech.2018.12.045
BindingDB Entry DOI: 10.7270/Q2RR224D
More data for this
Ligand-Target Pair