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Assay Detail

CHEMBL4177855

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Binding
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 real time PCR analysis
55
Total Activities
52
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

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

Target

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

Publication

Discovery of hepatitis B virus capsid assembly inhibitors leading to a heteroaryldihydropyrimidine based clinical candidate (GLS4).
Ren Q, Liu X, Luo Z, Li J, Wang C, Goldmann S, Zhang J, Zhang Y.
Bioorg Med Chem (2017) 25 : 1042 -1056
PubMed 28082068 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
EC50 52 7.02 9.62
EC90 3 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5314362 ENTECAVIR 4.0 1 9.62
CHEMBL3742114 2 9.00
CHEMBL4078766 1 8.52
CHEMBL4076401 1 8.30
CHEMBL4211812 1 8.22
CHEMBL4210470 1 8.00
CHEMBL4062770 1 7.80
CHEMBL4079561 1 7.70
CHEMBL4205737 1 7.58
CHEMBL4075908 1 7.46
CHEMBL4070728 1 7.38
CHEMBL605300 2 7.32
CHEMBL4077161 1 7.16
CHEMBL4206627 1 7.13
CHEMBL4216331 1 7.10
CHEMBL484 ADEFOVIR 3.0 1 7.08
CHEMBL4103602 1 7.00
CHEMBL4209011 1 7.00
CHEMBL3121560 2 7.00
CHEMBL4214974 1 6.82
CHEMBL4217281 1 6.70
CHEMBL483 TENOFOVIR ANHYDROUS 3.0 1 6.62
CHEMBL4208714 1 6.60
CHEMBL4204130 1 6.60
CHEMBL4064808 1 6.30
CHEMBL4203418 1 6.10
CHEMBL374731 TELBIVUDINE 4.0 1 6.09
CHEMBL4212848 1 6.05
CHEMBL4215086 1 5.92
CHEMBL4092509 1 5.51

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5314362 ENTECAVIR EC50 = 0.24 nM 9.62
CHEMBL3742114 EC50 = 1.0 nM 9.00
CHEMBL4078766 EC50 = 3.0 nM 8.52
CHEMBL4076401 EC50 = 5.0 nM 8.30
CHEMBL4211812 EC50 = 6.0 nM 8.22
CHEMBL4210470 EC50 = 10.0 nM 8.00
CHEMBL4062770 EC50 = 16.0 nM 7.80
CHEMBL4079561 EC50 = 20.0 nM 7.70
CHEMBL4205737 EC50 = 26.0 nM 7.58
CHEMBL4075908 EC50 = 35.0 nM 7.46
CHEMBL4070728 EC50 = 42.0 nM 7.38
CHEMBL605300 EC50 = 48.0 nM 7.32
CHEMBL4077161 EC50 = 69.0 nM 7.16
CHEMBL4206627 EC50 = 74.0 nM 7.13
CHEMBL4216331 EC50 = 80.0 nM 7.10
CHEMBL484 ADEFOVIR EC50 = 82.7 nM 7.08
CHEMBL4103602 EC50 = 100.0 nM 7.00
CHEMBL4209011 EC50 = 100.0 nM 7.00
CHEMBL3121560 EC50 = 100.0 nM 7.00
CHEMBL4214974 EC50 = 150.0 nM 6.82
CHEMBL4217281 EC50 = 200.0 nM 6.70
CHEMBL483 TENOFOVIR ANHYDROUS EC50 = 241.5 nM 6.62
CHEMBL4208714 EC50 = 250.0 nM 6.60
CHEMBL4204130 EC50 = 250.0 nM 6.60
CHEMBL4064808 EC50 = 500.0 nM 6.30
CHEMBL4203418 EC50 = 800.0 nM 6.10
CHEMBL374731 TELBIVUDINE EC50 = 819.4 nM 6.09
CHEMBL4212848 EC50 = 900.0 nM 6.05
CHEMBL4215086 EC50 = 1200.0 nM 5.92
CHEMBL4092509 EC50 = 3100.0 nM 5.51
CHEMBL4208472 EC50 = 3500.0 nM 5.46
CHEMBL4205239 EC50 = 4300.0 nM 5.37
CHEMBL4205574 EC50 = 5100.0 nM 5.29
CHEMBL3742114 EC90 = 6.0 nM -
CHEMBL4214335 EC50 > 16400.0 nM -
CHEMBL4202676 EC50 > 16400.0 nM -
CHEMBL605300 EC90 = 102.0 nM -
CHEMBL4218589 EC50 > 16400.0 nM -
CHEMBL4205837 EC50 > 16400.0 nM -
CHEMBL4099050 EC50 > 16400.0 nM -
CHEMBL4208895 EC50 > 16400.0 nM -
CHEMBL4211206 EC50 > 16400.0 nM -
CHEMBL4202690 EC50 > 16400.0 nM -
CHEMBL4087266 EC50 > 16400.0 nM -
CHEMBL4212364 EC50 > 16400.0 nM -
CHEMBL3121560 EC90 = 300.0 nM -
CHEMBL4205500 EC50 > 16400.0 nM -
CHEMBL4205160 EC50 > 16400.0 nM -
CHEMBL4210656 EC50 > 16400.0 nM -
CHEMBL4216143 EC50 > 16400.0 nM -