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Assay Detail

CHEMBL5384082

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

Binding
Binding affinity to alpha4beta7 integrin receptor (unknown origin) preincubated for 30 mins followed by 30 mins incubation in mucosal vascular add-ressin cell adhesion molecule 1 coated wells by fluorescence based assay
10
Total Activities
10
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 7 — Homologous single protein target
Curated By Autocuration

Target

Integrin alpha4/beta7 complex (CHEMBL5465395)
Type PROTEIN COMPLEX
Organism Homo sapiens

Publication

Design and Pharmacological Characterization of α<sub>4</sub>β<sub>1</sub> Integrin Cyclopeptide Agonists: Computational Investigation of Ligand Determinants for Agonism versus Antagonism.
Anselmi M, Baiula M, Spampinato S, Artali R, He T, Gentilucci L.
J Med Chem (2023) 66 : 5021 -5040
PubMed 36976921 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 10 7.26 7.64

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5408335 1 7.64
CHEMBL5410616 1 7.39
CHEMBL5395825 1 6.74
CHEMBL88478 1 -
CHEMBL5419935 1 -
CHEMBL5417237 1 -
CHEMBL4589062 1 -
CHEMBL4586928 1 -
CHEMBL5437666 1 -
CHEMBL5397743 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5408335 IC50 = 22.7 nM 7.64
CHEMBL5410616 IC50 = 41.0 nM 7.39
CHEMBL5395825 IC50 = 183.0 nM 6.74
CHEMBL88478 IC50 > 1000.0 nM -
CHEMBL5419935 IC50 > 1000.0 nM -
CHEMBL5417237 IC50 > 1000.0 nM -
CHEMBL4589062 IC50 > 5000.0 nM -
CHEMBL4586928 IC50 > 5000.0 nM -
CHEMBL5437666 IC50 > 5000.0 nM -
CHEMBL5397743 IC50 > 5000.0 nM -