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Assay Detail

CHEMBL4845505

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

Functional
Antagonist activity at CXCR4 receptor in human CCRF-CEM cells assessed as inhibition of SDF-1alpha-induced calcium release preincubated for 25 mins followed by SDF-1alpha addition and monitered for 90 sec
15
Total Activities
15
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Homo sapiens
Cell Type CCRF-CEM
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

C-X-C chemokine receptor type 4 (CHEMBL2107)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Amino-Heterocycle Tetrahydroisoquinoline CXCR4 Antagonists with Improved ADME Profiles via Late-Stage Buchwald Couplings.
Nguyen HH, Tahirovic YA, Truax VM, Wilson RJ, Jecs E, Miller EJ, Kim MB, Akins NS, Xu L, Jiang Y, Wang T, Sum CS, Cvijic ME, Schroeder GM, Wilson LJ, Liotta DC.
ACS Med Chem Lett (2021) 12 : 1605 -1612
PubMed 34676043 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 15 7.59 8.29

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL518924 MAVORIXAFOR 4.0 1 8.29
CHEMBL3091687 1 8.20
CHEMBL4862509 1 8.02
CHEMBL4853570 1 7.99
CHEMBL4877757 1 7.98
CHEMBL4863276 1 7.96
CHEMBL4875030 1 7.94
CHEMBL4857452 1 7.87
CHEMBL4874526 1 7.74
CHEMBL4862362 1 7.73
CHEMBL4846946 1 7.48
CHEMBL4876951 1 7.45
CHEMBL4858136 1 7.32
CHEMBL4864332 1 6.12
CHEMBL4849088 1 5.78

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL518924 MAVORIXAFOR IC50 = 5.18 nM 8.29
CHEMBL3091687 IC50 = 6.25 nM 8.20
CHEMBL4862509 IC50 = 9.56 nM 8.02
CHEMBL4853570 IC50 = 10.3 nM 7.99
CHEMBL4877757 IC50 = 10.4 nM 7.98
CHEMBL4863276 IC50 = 10.9 nM 7.96
CHEMBL4875030 IC50 = 11.4 nM 7.94
CHEMBL4857452 IC50 = 13.4 nM 7.87
CHEMBL4874526 IC50 = 18.1 nM 7.74
CHEMBL4862362 IC50 = 18.7 nM 7.73
CHEMBL4846946 IC50 = 33.4 nM 7.48
CHEMBL4876951 IC50 = 35.9 nM 7.45
CHEMBL4858136 IC50 = 47.4 nM 7.32
CHEMBL4864332 IC50 = 755.0 nM 6.12
CHEMBL4849088 IC50 = 1670.0 nM 5.78