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Assay Detail

CHEMBL4200409

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

Binding
Reactivation of NIMP-inhibited human recombinant AChE assessed as dissociation constant of inhibited enzyme-compound complex incubated for 1 to 10 mins by spectrophotometry based Ellman's assay
5
Total Activities
5
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

Acetylcholinesterase (CHEMBL220)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-Based Optimization of Nonquaternary Reactivators of Acetylcholinesterase Inhibited by Organophosphorus Nerve Agents.
Santoni G, de Sousa J, de la Mora E, Dias J, Jean L, Sussman JL, Silman I, Renard PY, Brown RCD, Weik M, Baati R, Nachon F.
J Med Chem (2018) 61 : 7630 -7639
PubMed 30125110 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 5 4.56 4.94

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4216666 1 4.94
CHEMBL3234588 1 4.70
CHEMBL33051 1 4.05
CHEMBL77510 1 -
CHEMBL451635 OBIDOXIME 2.0 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4216666 Kd = 11500.0 nM 4.94
CHEMBL3234588 Kd = 20000.0 nM 4.70
CHEMBL33051 Kd = 90000.0 nM 4.05
CHEMBL77510 Kd = 210000.0 nM -
CHEMBL451635 OBIDOXIME Kd = 500000.0 nM -