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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Capsid protein' and Ligand = 'BDBM50247735'   
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
Capsid protein


(Hepatitis B virus)
BDBM50247735
PNG
(CHEMBL4075908)
Show SMILES CCOC(=O)C1=C(CN2CCOCC2)NC(=NC1c1ccc(F)cc1Br)c1nncs1 |c:5,16|
Show InChI InChI=1S/C20H21BrFN5O3S/c1-2-30-20(28)16-15(10-27-5-7-29-8-6-27)24-18(19-26-23-11-31-19)25-17(16)13-4-3-12(22)9-14(13)21/h3-4,9,11,17H,2,5-8,10H2,1H3,(H,24,25)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 35n/an/an/an/a



Sunshine Lake Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of hepatitis B virus capsid assembly infected in human HepG2.215 cells assessed as reduction in viral DNA replication measured on day 7 by...


Bioorg Med Chem 25: 1042-1056 (2017)


Article DOI: 10.1016/j.bmc.2016.12.017
BindingDB Entry DOI: 10.7270/Q2ZC85F1
More data for this
Ligand-Target Pair