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Assay Detail

CHEMBL4033373

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

ADMET
Inhibition of human PAK1 kinase domain using coumarin and fluorescein-labeled ser/thr19 peptide as substrate preincubated for 15 mins followed by ATP addition measured after 60 mins by Z'-Lyte assay
26
Total Activities
26
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Serine/threonine-protein kinase PAK 1 (CHEMBL4600)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-Based Design of 6-Chloro-4-aminoquinazoline-2-carboxamide Derivatives as Potent and Selective p21-Activated Kinase 4 (PAK4) Inhibitors.
Hao C, Zhao F, Song H, Guo J, Li X, Jiang X, Huan R, Song S, Zhang Q, Wang R, Wang K, Pang Y, Liu T, Lu T, Huang W, Wang J, Lin B, He Z, Li H, Li F, Zhao D, Cheng M.
J Med Chem (2018) 61 : 265 -285
PubMed 29190083 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 26 6.03 6.54

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4076708 1 6.54
CHEMBL4076860 1 6.43
CHEMBL4063425 1 6.42
CHEMBL4081464 1 6.40
CHEMBL4059493 1 6.30
CHEMBL4077032 1 6.16
CHEMBL4101547 1 5.97
CHEMBL4091048 1 5.72
CHEMBL4090101 1 5.68
CHEMBL4089338 1 5.68
CHEMBL4064068 1 5.56
CHEMBL4097816 1 5.51
CHEMBL4102034 1 -
CHEMBL4097647 1 -
CHEMBL4071328 1 -
CHEMBL4060217 1 -
CHEMBL4093805 1 -
CHEMBL4093999 1 -
CHEMBL4095362 1 -
CHEMBL4069022 1 -
CHEMBL4079783 1 -
CHEMBL4059904 1 -
CHEMBL4062257 1 -
CHEMBL4090268 1 -
CHEMBL4084054 1 -
CHEMBL4068155 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4076708 Ki = 288.0 nM 6.54
CHEMBL4076860 Ki = 368.0 nM 6.43
CHEMBL4063425 Ki = 383.0 nM 6.42
CHEMBL4081464 Ki = 401.0 nM 6.40
CHEMBL4059493 Ki = 503.0 nM 6.30
CHEMBL4077032 Ki = 690.0 nM 6.16
CHEMBL4101547 Ki = 1072.0 nM 5.97
CHEMBL4091048 Ki = 1891.0 nM 5.72
CHEMBL4090101 Ki = 2080.0 nM 5.68
CHEMBL4089338 Ki = 2085.0 nM 5.68
CHEMBL4064068 Ki = 2750.0 nM 5.56
CHEMBL4097816 Ki = 3112.0 nM 5.51
CHEMBL4102034 Ki - -
CHEMBL4097647 Ki - -
CHEMBL4071328 Ki - -
CHEMBL4060217 Ki - -
CHEMBL4093805 Ki - -
CHEMBL4093999 Ki > 10000.0 nM -
CHEMBL4095362 Ki > 4520.0 nM -
CHEMBL4069022 Ki > 4520.0 nM -
CHEMBL4079783 Ki > 10000.0 nM -
CHEMBL4059904 Ki > 4520.0 nM -
CHEMBL4062257 Ki - -
CHEMBL4090268 Ki > 4520.0 nM -
CHEMBL4084054 Ki > 10.0 nM -
CHEMBL4068155 Ki > 4520.0 nM -