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Assay Detail

CHEMBL4224334

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

Binding
Inhibition of ERK2 (unknown origin)
23
Total Activities
23
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

Mitogen-activated protein kinase 1 (CHEMBL4040)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of 3(S)-thiomethyl pyrrolidine ERK inhibitors for oncology.
Boga SB, Alhassan AB, Cooper AB, Doll R, Shih NY, Shipps G, Deng Y, Zhu H, Nan Y, Sun R, Zhu L, Desai J, Patel M, Muppalla K, Gao X, Wang J, Yao X, Kelly J, Gudipati S, Paliwal S, Tsui HC, Wang T, Sherborne B, Xiao L, Hruza A, Buevich A, Zhang LK, Hesk D, Samatar AA, Carr D, Long B, Black S, Dayananth P, Windsor W, Kirschmeier P, Bishop R.
Bioorg Med Chem Lett (2018) 28 : 2029 -2034
PubMed 29748051 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 23 7.54 8.68

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3645233 1 8.68
CHEMBL3645231 1 8.32
CHEMBL4225841 1 8.26
CHEMBL4215228 1 8.25
CHEMBL4225054 1 8.24
CHEMBL3645235 1 8.15
CHEMBL4226533 1 8.01
CHEMBL4228552 1 7.92
CHEMBL4229079 1 7.85
CHEMBL4224792 1 7.81
CHEMBL4228453 1 7.68
CHEMBL4228816 1 7.62
CHEMBL4228493 1 7.60
CHEMBL3645228 1 7.39
CHEMBL4225852 1 7.05
CHEMBL4227512 1 6.94
CHEMBL4228960 1 6.92
CHEMBL4226108 1 6.24
CHEMBL4225250 1 6.02
CHEMBL4227869 1 5.88
CHEMBL4224725 1 -
CHEMBL4228559 1 -
CHEMBL4227448 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3645233 IC50 = 2.1 nM 8.68
CHEMBL3645231 IC50 = 4.8 nM 8.32
CHEMBL4225841 IC50 = 5.5 nM 8.26
CHEMBL4215228 IC50 = 5.6 nM 8.25
CHEMBL4225054 IC50 = 5.8 nM 8.24
CHEMBL3645235 IC50 = 7.0 nM 8.15
CHEMBL4226533 IC50 = 9.7 nM 8.01
CHEMBL4228552 IC50 = 12.0 nM 7.92
CHEMBL4229079 IC50 = 14.0 nM 7.85
CHEMBL4224792 IC50 = 15.5 nM 7.81
CHEMBL4228453 IC50 = 21.0 nM 7.68
CHEMBL4228816 IC50 = 24.0 nM 7.62
CHEMBL4228493 IC50 = 25.0 nM 7.60
CHEMBL3645228 IC50 = 41.0 nM 7.39
CHEMBL4225852 IC50 = 90.0 nM 7.05
CHEMBL4227512 IC50 = 115.0 nM 6.94
CHEMBL4228960 IC50 = 119.0 nM 6.92
CHEMBL4226108 IC50 = 574.0 nM 6.24
CHEMBL4225250 IC50 = 960.0 nM 6.02
CHEMBL4227869 IC50 = 1311.0 nM 5.88
CHEMBL4224725 IC50 > 3000.0 nM -
CHEMBL4228559 IC50 > 1000.0 nM -
CHEMBL4227448 IC50 > 3000.0 nM -