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Assay Detail

CHEMBL654808

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

Binding
In vitro binding affinity at CCR5 receptor in the presence of [125I]-MIP-1 alpha.
23
Total Activities
22
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Expert

Target

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

Publication

1,3,4-Trisubstituted pyrrolidine CCR5 receptor antagonists. Part 4: synthesis of N-1 acidic functionality affording analogues with enhanced antiviral activity against HIV.
Lynch CL, Hale JJ, Budhu RJ, Gentry AL, Mills SG, Chapman KT, MacCoss M, Malkowitz L, Springer MS, Gould SL, DeMartino JA, Siciliano SJ, Cascieri MA, Carella A, Carver G, Holmes K, Schleif WA, Danzeisen R, Hazuda D, Kessler J, Lineberger J, Miller M, Emini EA.
Bioorg Med Chem Lett (2002) 12 : 3001 -3004
PubMed 12270193 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 23 8.95 10.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL20896 1 10.00
CHEMBL320386 1 10.00
CHEMBL102826 1 10.00
CHEMBL316475 1 10.00
CHEMBL99909 1 9.70
CHEMBL319593 1 9.70
CHEMBL322603 2 9.30
CHEMBL318406 1 9.15
CHEMBL101961 1 9.10
CHEMBL103343 1 9.00
CHEMBL99788 1 9.00
CHEMBL103813 1 9.00
CHEMBL318210 1 8.70
CHEMBL102675 1 8.52
CHEMBL318681 1 8.52
CHEMBL101333 1 8.44
CHEMBL103782 1 8.40
CHEMBL100958 1 8.40
CHEMBL100596 1 8.30
CHEMBL102674 1 8.22
CHEMBL322232 1 7.62
CHEMBL322693 1 7.44

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL320386 IC50 = 0.1 nM 10.00
CHEMBL102826 IC50 = 0.1 nM 10.00
CHEMBL20896 IC50 = 0.1 nM 10.00
CHEMBL316475 IC50 = 0.1 nM 10.00
CHEMBL319593 IC50 = 0.2 nM 9.70
CHEMBL99909 IC50 = 0.2 nM 9.70
CHEMBL322603 IC50 = 0.5 nM 9.30
CHEMBL322603 IC50 = 0.5 nM 9.30
CHEMBL318406 IC50 = 0.7 nM 9.15
CHEMBL101961 IC50 = 0.8 nM 9.10
CHEMBL103343 IC50 = 1.0 nM 9.00
CHEMBL103813 IC50 = 1.0 nM 9.00
CHEMBL99788 IC50 = 1.0 nM 9.00
CHEMBL318210 IC50 = 2.0 nM 8.70
CHEMBL102675 IC50 = 3.0 nM 8.52
CHEMBL318681 IC50 = 3.0 nM 8.52
CHEMBL101333 IC50 = 3.6 nM 8.44
CHEMBL103782 IC50 = 4.0 nM 8.40
CHEMBL100958 IC50 = 4.0 nM 8.40
CHEMBL100596 IC50 = 5.0 nM 8.30
CHEMBL102674 IC50 = 6.0 nM 8.22
CHEMBL322232 IC50 = 24.0 nM 7.62
CHEMBL322693 IC50 = 36.0 nM 7.44