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Assay Detail

CHEMBL4416859

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of capsid in HBV infected in human HepG.2.2.15 cells assessed as reduction of HBV DNA incubated for 5 days by quantitative PCR analysis
22
Total Activities
22
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Hepatitis B virus
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Core antigen (CHEMBL1075091)
Type SINGLE PROTEIN
Organism Hepatitis B virus

Publication

A New Approach of Mitigating CYP3A4 Induction Led to the Discovery of Potent Hepatitis B Virus (HBV) Capsid Inhibitor with Optimal ADMET Profiles.
Lin X, Shi H, Zhang W, Qiu Z, Zhou Z, Dey F, Zhong S, Qiu H, Xie J, Zhou X, Yang G, Tang G, Shen HC, Zhu W.
J Med Chem (2019) 62 : 10352 -10361
PubMed 31689116 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
EC50 22 8.07 8.70

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4587268 1 8.70
CHEMBL4077913 1 8.70
CHEMBL4064672 1 8.52
CHEMBL4446995 1 8.52
CHEMBL4577679 1 8.52
CHEMBL4517178 1 8.30
CHEMBL4580643 1 8.30
CHEMBL4567962 1 8.00
CHEMBL4447713 1 8.00
CHEMBL4449828 1 8.00
CHEMBL4452181 1 7.96
CHEMBL4090739 1 7.85
CHEMBL4465875 1 7.82
CHEMBL4069741 1 7.82
CHEMBL4452168 1 7.75
CHEMBL4470025 1 7.66
CHEMBL4462465 1 7.55
CHEMBL4476494 1 7.34
CHEMBL4459737 1 -
CHEMBL4466969 1 -
CHEMBL4451367 1 -
CHEMBL4541951 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4587268 EC50 = 2.0 nM 8.70
CHEMBL4077913 EC50 = 2.0 nM 8.70
CHEMBL4064672 EC50 = 3.0 nM 8.52
CHEMBL4446995 EC50 = 3.0 nM 8.52
CHEMBL4577679 EC50 = 3.0 nM 8.52
CHEMBL4517178 EC50 = 5.0 nM 8.30
CHEMBL4580643 EC50 = 5.0 nM 8.30
CHEMBL4567962 EC50 = 10.0 nM 8.00
CHEMBL4447713 EC50 = 10.0 nM 8.00
CHEMBL4449828 EC50 = 10.0 nM 8.00
CHEMBL4452181 EC50 = 11.0 nM 7.96
CHEMBL4090739 EC50 = 14.0 nM 7.85
CHEMBL4465875 EC50 = 15.0 nM 7.82
CHEMBL4069741 EC50 = 15.0 nM 7.82
CHEMBL4452168 EC50 = 18.0 nM 7.75
CHEMBL4470025 EC50 = 22.0 nM 7.66
CHEMBL4462465 EC50 = 28.0 nM 7.55
CHEMBL4476494 EC50 = 46.0 nM 7.34
CHEMBL4459737 EC50 > 1000.0 nM -
CHEMBL4466969 EC50 > 1000.0 nM -
CHEMBL4451367 EC50 > 1000.0 nM -
CHEMBL4541951 EC50 - -