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Assay Detail

CHEMBL1110057

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

Functional
Antiviral activity against HIV1 3B infected in human HOS cells expressing human CXCR4/CCR5/CD4/pHIV-LTR luciferase assessed as inhibition of viral infection to cells
29
Total Activities
29
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Human immunodeficiency virus 1
Cell Type HOS
Confidence 1 — Organism
Curated By Autocuration

Target

Human immunodeficiency virus 1 (CHEMBL378)
Type ORGANISM
Organism Human immunodeficiency virus 1

Publication

Synthesis and SAR of novel isoquinoline CXCR4 antagonists with potent anti-HIV activity.
Miller JF, Gudmundsson KS, D'Aurora Richardson L, Jenkinson S, Spaltenstein A, Thomson M, Wheelan P.
Bioorg Med Chem Lett (2010) 20 : 3026 -3030
PubMed 20443225 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 29 7.56 8.70

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL568653 1 8.70
CHEMBL1096504 1 8.30
CHEMBL518924 MAVORIXAFOR 4.0 1 8.00
CHEMBL1098464 1 7.96
CHEMBL1094870 1 7.92
CHEMBL1094864 1 7.92
CHEMBL1098156 1 7.92
CHEMBL1096503 1 7.92
CHEMBL1096154 1 7.80
CHEMBL1096505 1 7.77
CHEMBL568447 1 7.77
CHEMBL1097110 1 7.70
CHEMBL1094871 1 7.68
CHEMBL1088913 1 7.64
CHEMBL1097108 1 7.57
CHEMBL1097821 1 7.47
CHEMBL1098199 1 7.42
CHEMBL1094245 1 7.39
CHEMBL1097461 1 7.38
CHEMBL1095179 1 7.36
CHEMBL1097109 1 7.32
CHEMBL1099015 1 7.16
CHEMBL1096141 1 7.14
CHEMBL1097459 1 6.92
CHEMBL1097505 1 6.80
CHEMBL1097504 1 6.70
CHEMBL1099358 1 6.47
CHEMBL1097460 1 -
CHEMBL1097820 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL568653 IC50 = 2.0 nM 8.70
CHEMBL1096504 IC50 = 5.0 nM 8.30
CHEMBL518924 MAVORIXAFOR IC50 = 10.0 nM 8.00
CHEMBL1098464 IC50 = 11.0 nM 7.96
CHEMBL1094870 IC50 = 12.0 nM 7.92
CHEMBL1094864 IC50 = 12.0 nM 7.92
CHEMBL1098156 IC50 = 12.0 nM 7.92
CHEMBL1096503 IC50 = 12.0 nM 7.92
CHEMBL1096154 IC50 = 16.0 nM 7.80
CHEMBL1096505 IC50 = 17.0 nM 7.77
CHEMBL568447 IC50 = 17.0 nM 7.77
CHEMBL1097110 IC50 = 20.0 nM 7.70
CHEMBL1094871 IC50 = 21.0 nM 7.68
CHEMBL1088913 IC50 = 23.0 nM 7.64
CHEMBL1097108 IC50 = 27.0 nM 7.57
CHEMBL1097821 IC50 = 34.0 nM 7.47
CHEMBL1098199 IC50 = 38.0 nM 7.42
CHEMBL1094245 IC50 = 41.0 nM 7.39
CHEMBL1097461 IC50 = 42.0 nM 7.38
CHEMBL1095179 IC50 = 44.0 nM 7.36
CHEMBL1097109 IC50 = 48.0 nM 7.32
CHEMBL1099015 IC50 = 70.0 nM 7.16
CHEMBL1096141 IC50 = 72.0 nM 7.14
CHEMBL1097459 IC50 = 120.0 nM 6.92
CHEMBL1097505 IC50 = 160.0 nM 6.80
CHEMBL1097504 IC50 = 200.0 nM 6.70
CHEMBL1099358 IC50 = 340.0 nM 6.47
CHEMBL1097460 IC50 > 20000.0 nM -
CHEMBL1097820 IC50 > 20000.0 nM -