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Assay Detail

CHEMBL1174016

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

Functional
Antagonist activity at CCR5 expressed in CHO cells assessed as inhibition of RANTES-induced [35S]GTPgamma binding by scintillation proximity assay
32
Total Activities
32
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Cell Type CHO
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

C-C chemokine receptor type 5 (CHEMBL274)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Studies on the structure-activity relationship of 1,3,3,4-tetra-substituted pyrrolidine embodied CCR5 receptor antagonists. Part 1: Tuning the N-substituents.
Ben L, Jones ED, Zhou E, Li C, Baylis DC, Yu S, Wang M, He X, Coates JA, Rhodes DI, Pei G, Deadman JJ, Xie X, Ma D.
Bioorg Med Chem Lett (2010) 20 : 4012 -4014
PubMed 20561788 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 32 8.14 8.96

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1172048 1 8.96
CHEMBL1172043 1 8.96
CHEMBL1172625 1 8.81
CHEMBL1172050 1 8.79
CHEMBL1172045 1 8.77
CHEMBL1172051 1 8.77
CHEMBL1172624 1 8.68
CHEMBL1172046 1 8.57
CHEMBL1172035 NIFEVIROC 1 8.54
CHEMBL1172052 1 8.53
CHEMBL1172047 1 8.49
CHEMBL1172626 1 8.48
CHEMBL1172157 1 8.46
CHEMBL1171030 1 8.44
CHEMBL1172623 1 8.40
CHEMBL1172053 1 8.30
CHEMBL1172439 1 8.28
CHEMBL1172049 1 8.21
CHEMBL1172036 1 8.21
CHEMBL1172039 1 8.21
CHEMBL1171965 1 8.06
CHEMBL1171029 1 7.96
CHEMBL1172438 1 7.84
CHEMBL1169819 1 7.75
CHEMBL1172044 1 7.70
CHEMBL1172040 1 7.43
CHEMBL1171966 1 7.42
CHEMBL1172041 1 6.95
CHEMBL1172037 1 6.91
CHEMBL1172622 1 6.83

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1172048 IC50 = 1.09 nM 8.96
CHEMBL1172043 IC50 = 1.09 nM 8.96
CHEMBL1172625 IC50 = 1.53 nM 8.81
CHEMBL1172050 IC50 = 1.62 nM 8.79
CHEMBL1172045 IC50 = 1.71 nM 8.77
CHEMBL1172051 IC50 = 1.69 nM 8.77
CHEMBL1172624 IC50 = 2.1 nM 8.68
CHEMBL1172046 IC50 = 2.66 nM 8.57
CHEMBL1172035 NIFEVIROC IC50 = 2.9 nM 8.54
CHEMBL1172052 IC50 = 2.93 nM 8.53
CHEMBL1172047 IC50 = 3.2 nM 8.49
CHEMBL1172626 IC50 = 3.32 nM 8.48
CHEMBL1172157 IC50 = 3.5 nM 8.46
CHEMBL1171030 IC50 = 3.6 nM 8.44
CHEMBL1172623 IC50 = 4.0 nM 8.40
CHEMBL1172053 IC50 = 5.0 nM 8.30
CHEMBL1172439 IC50 = 5.3 nM 8.28
CHEMBL1172049 IC50 = 6.15 nM 8.21
CHEMBL1172036 IC50 = 6.22 nM 8.21
CHEMBL1172039 IC50 = 6.15 nM 8.21
CHEMBL1171965 IC50 = 8.75 nM 8.06
CHEMBL1171029 IC50 = 11.0 nM 7.96
CHEMBL1172438 IC50 = 14.6 nM 7.84
CHEMBL1169819 IC50 = 17.8 nM 7.75
CHEMBL1172044 IC50 = 20.2 nM 7.70
CHEMBL1172040 IC50 = 37.3 nM 7.43
CHEMBL1171966 IC50 = 37.7 nM 7.42
CHEMBL1172041 IC50 = 113.6 nM 6.95
CHEMBL1172037 IC50 = 122.0 nM 6.91
CHEMBL1172622 IC50 = 149.2 nM 6.83
CHEMBL1172042 IC50 = 220.6 nM 6.66
CHEMBL1172038 IC50 > 30.0 nM -