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Assay Detail

CHEMBL4380479

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

Binding
Competitive inhibition of human N-terminal His6-SUMO tagged WDR5 (22 to 334 residues) expressed in Escherichia coli BL21-Gold(DE3) cells using 10-mer-Thr-FAM peptide as substrate after 1 hr by TR-FRET assay
22
Total Activities
22
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

WD repeat-containing protein 5 (CHEMBL1075317)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery and Structure-Based Optimization of Potent and Selective WD Repeat Domain 5 (WDR5) Inhibitors Containing a Dihydroisoquinolinone Bicyclic Core.
Tian J, Teuscher KB, Aho ER, Alvarado JR, Mills JJ, Meyers KM, Gogliotti RD, Han C, Macdonald JD, Sai J, Shaw JG, Sensintaffar JL, Zhao B, Rietz TA, Thomas LR, Payne WG, Moore WJ, Stott GM, Kondo J, Inoue M, Coffey RJ, Tansey WP, Stauffer SR, Lee T, Fesik SW.
J Med Chem (2020) 63 : 656 -675
PubMed 31858797 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 21 10.04 10.64
Ki 1 10.36 10.36

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4463486 1 10.64
CHEMBL4476662 1 10.57
CHEMBL4534270 1 10.52
CHEMBL4557848 1 10.52
CHEMBL4585441 1 10.49
CHEMBL4530969 1 10.48
CHEMBL4439051 1 10.46
CHEMBL4453355 1 10.37
CHEMBL4441671 1 10.36
CHEMBL4435250 1 10.31
CHEMBL4555492 1 10.26
CHEMBL4593719 1 10.21
CHEMBL4556167 1 10.20
CHEMBL4474045 1 10.05
CHEMBL4578661 1 9.85
CHEMBL4436638 1 9.80
CHEMBL4570860 1 9.30
CHEMBL4567878 1 8.82
CHEMBL4528067 1 7.80
CHEMBL4463776 1 -
CHEMBL4588661 1 -
CHEMBL4462065 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4463486 Kd = 0.023 nM 10.64
CHEMBL4476662 Kd = 0.027 nM 10.57
CHEMBL4534270 Kd = 0.03 nM 10.52
CHEMBL4557848 Kd = 0.03 nM 10.52
CHEMBL4585441 Kd = 0.032 nM 10.49
CHEMBL4530969 Kd = 0.033 nM 10.48
CHEMBL4439051 Kd = 0.035 nM 10.46
CHEMBL4453355 Kd = 0.043 nM 10.37
CHEMBL4441671 Ki = 0.044 nM 10.36
CHEMBL4435250 Kd = 0.049 nM 10.31
CHEMBL4555492 Kd = 0.055 nM 10.26
CHEMBL4593719 Kd = 0.061 nM 10.21
CHEMBL4556167 Kd = 0.063 nM 10.20
CHEMBL4474045 Kd = 0.09 nM 10.05
CHEMBL4578661 Kd = 0.14 nM 9.85
CHEMBL4436638 Kd = 0.16 nM 9.80
CHEMBL4570860 Kd = 0.5 nM 9.30
CHEMBL4567878 Kd = 1.5 nM 8.82
CHEMBL4528067 Kd = 16.0 nM 7.80
CHEMBL4463776 Kd < 0.02 nM -
CHEMBL4588661 Kd < 0.02 nM -
CHEMBL4462065 Kd < 0.02 nM -