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Assay Detail

CHEMBL4149799

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

Functional
Antagonist activity at CXCR4 in human CCRF-CEM cells assessed as inhibition of SDS1alpha-induced calcium flux pretreated for 25 mins followed by SDS1alpha addition measured for 90 secs by calcium-dye based assay
22
Total Activities
22
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

Discovery of N-Alkyl Piperazine Side Chain Based CXCR4 Antagonists with Improved Drug-like Properties.
Tahirovic YA, Truax VM, Wilson RJ, Jecs E, Nguyen HH, Miller EJ, Kim MB, Kuo KM, Wang T, Sum CS, Cvijic ME, Schroeder GM, Wilson LJ, Liotta DC.
ACS Med Chem Lett (2018) 9 : 446 -451
PubMed 29795757 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 22 6.92 8.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL518924 MAVORIXAFOR 4.0 1 8.30
CHEMBL3091687 1 8.22
CHEMBL4174290 1 7.80
CHEMBL4167058 1 7.77
CHEMBL4172802 1 7.77
CHEMBL4175653 1 7.48
CHEMBL4161613 1 7.35
CHEMBL4167654 1 7.30
CHEMBL4159991 1 7.21
CHEMBL4159410 1 7.19
CHEMBL4159150 1 7.18
CHEMBL4165032 1 6.90
CHEMBL4164702 1 6.82
CHEMBL4163611 1 6.79
CHEMBL4175350 1 6.77
CHEMBL4170141 1 6.27
CHEMBL4166456 1 6.26
CHEMBL4160551 1 6.02
CHEMBL4170857 1 5.94
CHEMBL4172234 1 5.92
CHEMBL4167467 1 5.58
CHEMBL4162125 1 5.37

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL518924 MAVORIXAFOR IC50 = 5.0 nM 8.30
CHEMBL3091687 IC50 = 6.0 nM 8.22
CHEMBL4174290 IC50 = 16.0 nM 7.80
CHEMBL4167058 IC50 = 17.0 nM 7.77
CHEMBL4172802 IC50 = 17.0 nM 7.77
CHEMBL4175653 IC50 = 33.0 nM 7.48
CHEMBL4161613 IC50 = 45.0 nM 7.35
CHEMBL4167654 IC50 = 50.0 nM 7.30
CHEMBL4159991 IC50 = 62.0 nM 7.21
CHEMBL4159410 IC50 = 65.0 nM 7.19
CHEMBL4159150 IC50 = 66.0 nM 7.18
CHEMBL4165032 IC50 = 125.0 nM 6.90
CHEMBL4164702 IC50 = 150.0 nM 6.82
CHEMBL4163611 IC50 = 161.0 nM 6.79
CHEMBL4175350 IC50 = 171.0 nM 6.77
CHEMBL4170141 IC50 = 536.0 nM 6.27
CHEMBL4166456 IC50 = 553.0 nM 6.26
CHEMBL4160551 IC50 = 959.0 nM 6.02
CHEMBL4170857 IC50 = 1154.0 nM 5.94
CHEMBL4172234 IC50 = 1199.0 nM 5.92
CHEMBL4167467 IC50 = 2639.0 nM 5.58
CHEMBL4162125 IC50 = 4316.0 nM 5.37