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Assay Detail

CHEMBL5217617

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

Binding
Binding affinity to Keap1 kelch domain (unknown origin) by surface plasmon resonance assay
41
Total Activities
38
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

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

Target

Kelch-like ECH-associated protein 1 (CHEMBL2069156)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Development of Noncovalent Small-Molecule Keap1-Nrf2 Inhibitors by Fragment-Based Drug Discovery.
Narayanan D, Tran KT, Pallesen JS, Solbak SMØ, Qin Y, Mukminova E, Luchini M, Vasilyeva KO, González Chichón D, Goutsiou G, Poulsen C, Haapanen N, Popowicz GM, Sattler M, Olagnier D, Gajhede M, Bach A.
J Med Chem (2022) 65 : 14481 -14526
PubMed 36263945 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 36 3.29 9.15
Activity 5 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4643134 1 9.15
CHEMBL3358228 1 4.08
CHEMBL5218656 1 3.66
CHEMBL5220573 1 3.52
CHEMBL158697 1 3.52
CHEMBL5219654 1 3.32
CHEMBL1486504 2 3.27
CHEMBL5218868 1 3.25
CHEMBL4585642 1 3.22
CHEMBL5219398 2 3.10
CHEMBL5219152 2 3.09
CHEMBL1230159 1 3.08
CHEMBL5218920 1 3.07
CHEMBL5220217 1 3.05
CHEMBL5220238 1 3.05
CHEMBL5218944 1 3.00
CHEMBL4856216 1 3.00
CHEMBL1874593 1 3.00
CHEMBL3187039 1 3.00
CHEMBL5219344 1 2.96
CHEMBL5218544 1 2.92
CHEMBL4868334 1 2.92
CHEMBL190660 1 2.80
CHEMBL5219161 1 2.77
CHEMBL1555771 1 2.75
CHEMBL2018159 1 2.75
CHEMBL5220089 1 2.75
CHEMBL5220689 1 2.48
CHEMBL5219525 1 -
CHEMBL5219260 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4643134 Kd = 0.7 nM 9.15
CHEMBL3358228 Kd = 84000.0 nM 4.08
CHEMBL5218656 Kd = 220000.0 nM 3.66
CHEMBL5220573 Kd = 300000.0 nM 3.52
CHEMBL158697 Kd = 300000.0 nM 3.52
CHEMBL5219654 Kd = 480000.0 nM 3.32
CHEMBL1486504 Kd = 540000.0 nM 3.27
CHEMBL1486504 Kd = 540000.0 nM 3.27
CHEMBL5218868 Kd = 560000.0 nM 3.25
CHEMBL4585642 Kd = 600000.0 nM 3.22
CHEMBL5219398 Kd = 790000.0 nM 3.10
CHEMBL5219398 Kd = 790000.0 nM 3.10
CHEMBL5219152 Kd = 820000.0 nM 3.09
CHEMBL5219152 Kd = 820000.0 nM 3.09
CHEMBL1230159 Kd = 840000.0 nM 3.08
CHEMBL5218920 Kd = 850000.0 nM 3.07
CHEMBL5220217 Kd = 900000.0 nM 3.05
CHEMBL5220238 Kd = 900000.0 nM 3.05
CHEMBL3187039 Kd = 1000000.0 nM 3.00
CHEMBL4856216 Kd = 1000000.0 nM 3.00
CHEMBL5218944 Kd = 1000000.0 nM 3.00
CHEMBL1874593 Kd = 1000000.0 nM 3.00
CHEMBL5219344 Kd = 1100000.0 nM 2.96
CHEMBL4868334 Kd = 1200000.0 nM 2.92
CHEMBL5218544 Kd = 1200000.0 nM 2.92
CHEMBL190660 Kd = 1600000.0 nM 2.80
CHEMBL5219161 Kd = 1700000.0 nM 2.77
CHEMBL2018159 Kd = 1800000.0 nM 2.75
CHEMBL5220089 Kd = 1800000.0 nM 2.75
CHEMBL1555771 Kd = 1800000.0 nM 2.75
CHEMBL5220689 Kd = 3300000.0 nM 2.48
CHEMBL5219196 Kd = 360000000.0 nM -
CHEMBL5219260 Kd = 350000000.0 nM -
CHEMBL5219525 Kd = 350000000.0 nM -
CHEMBL5218914 Activity - -
CHEMBL1404172 Activity - -
CHEMBL5218773 Activity - -
CHEMBL5219387 Activity - -
CHEMBL5218662 Kd = 310000000.0 nM -
CHEMBL1303660 Kd = 190000000.0 nM -
CHEMBL5220047 Activity - -