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Assay Detail

CHEMBL5350899

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

Binding
Binding affinity to human ACE assessed as binding constant by surface plasmon resonance analysis
25
Total Activities
25
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Angiotensin-converting enzyme (CHEMBL1808)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-Guided Chemical Optimization of Bicyclic Peptide (<i>Bicycle</i>) Inhibitors of Angiotensin-Converting Enzyme 2.
Harman MAJ, Stanway SJ, Scott H, Demydchuk Y, Bezerra GA, Pellegrino S, Chen L, Brear P, Lulla A, Hyvönen M, Beswick PJ, Skynner MJ.
J Med Chem (2023) 66 : 9881 -9893
PubMed 37433017 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 25 5.55 6.46

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5420202 1 6.46
CHEMBL5403774 1 5.42
CHEMBL5415513 1 5.29
CHEMBL5433480 1 5.02
CHEMBL5396932 1 -
CHEMBL5434641 1 -
CHEMBL5407252 1 -
CHEMBL5429094 1 -
CHEMBL5434946 1 -
CHEMBL5420290 1 -
CHEMBL5410380 1 -
CHEMBL5402703 1 -
CHEMBL5429801 1 -
CHEMBL5394399 1 -
CHEMBL5430631 1 -
CHEMBL5406655 1 -
CHEMBL5424883 1 -
CHEMBL5437403 1 -
CHEMBL5400018 1 -
CHEMBL5424641 1 -
CHEMBL5429562 1 -
CHEMBL5397691 1 -
CHEMBL5415414 1 -
CHEMBL5395954 1 -
CHEMBL5400083 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5420202 Kd = 350.0 nM 6.46
CHEMBL5403774 Kd = 3800.0 nM 5.42
CHEMBL5415513 Kd = 5100.0 nM 5.29
CHEMBL5433480 Kd = 9500.0 nM 5.02
CHEMBL5396932 Kd > 10000.0 nM -
CHEMBL5434641 Kd > 10000.0 nM -
CHEMBL5407252 Kd > 10000.0 nM -
CHEMBL5429094 Kd > 10000.0 nM -
CHEMBL5434946 Kd > 10000.0 nM -
CHEMBL5420290 Kd > 10000.0 nM -
CHEMBL5410380 Kd > 10000.0 nM -
CHEMBL5402703 Kd > 10000.0 nM -
CHEMBL5429801 Kd > 10000.0 nM -
CHEMBL5394399 Kd > 10000.0 nM -
CHEMBL5430631 Kd > 10000.0 nM -
CHEMBL5406655 Kd > 10000.0 nM -
CHEMBL5424883 Kd > 10000.0 nM -
CHEMBL5437403 Kd > 10000.0 nM -
CHEMBL5400018 Kd > 10000.0 nM -
CHEMBL5424641 Kd > 10000.0 nM -
CHEMBL5429562 Kd > 10000.0 nM -
CHEMBL5397691 Kd > 10000.0 nM -
CHEMBL5415414 Kd > 10000.0 nM -
CHEMBL5395954 Kd > 10000.0 nM -
CHEMBL5400083 Kd > 10000.0 nM -