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Assay Detail

CHEMBL5364218

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

Binding
Binding affinity to full-length recombinant human NNMT expressed in Escherichia coli BL21(DE3) cells assessed as inhibition constant preincubated for 30 mins followed by FP probe addition measured after 30 mins by fluorescence polarization competition assay
28
Total Activities
28
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

Nicotinamide N-methyltransferase (CHEMBL2346486)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-Activity Relationship Studies on Cell-Potent Nicotinamide <i>N</i>-Methyltransferase Bisubstrate Inhibitors.
Iyamu ID, Zhao T, Huang R.
J Med Chem (2023) 66 : 10510 -10527
PubMed 37523719 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 28 6.04 7.72

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5408922 1 7.72
CHEMBL5433732 1 7.42
CHEMBL5407922 1 7.32
CHEMBL5400606 1 7.31
CHEMBL5437399 1 7.28
CHEMBL5420435 1 7.14
CHEMBL5403173 1 7.11
CHEMBL5401131 1 7.02
CHEMBL5432183 1 6.85
CHEMBL5399278 1 6.72
CHEMBL5432345 1 6.35
CHEMBL5426689 1 6.19
CHEMBL5417206 1 6.07
CHEMBL5424430 1 5.85
CHEMBL5409370 1 5.85
CHEMBL5425170 1 5.68
CHEMBL5434313 1 5.66
CHEMBL5406466 1 5.55
CHEMBL5411190 1 5.50
CHEMBL5434023 1 5.39
CHEMBL5404950 1 5.27
CHEMBL5395424 1 5.00
CHEMBL5395340 1 4.96
CHEMBL5433740 1 4.92
CHEMBL5429300 1 4.85
CHEMBL5407102 1 4.77
CHEMBL5414706 1 4.68
CHEMBL5411538 1 4.66

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5408922 Ki = 19.0 nM 7.72
CHEMBL5433732 Ki = 38.0 nM 7.42
CHEMBL5407922 Ki = 48.0 nM 7.32
CHEMBL5400606 Ki = 49.0 nM 7.31
CHEMBL5437399 Ki = 52.0 nM 7.28
CHEMBL5420435 Ki = 72.0 nM 7.14
CHEMBL5403173 Ki = 77.0 nM 7.11
CHEMBL5401131 Ki = 95.0 nM 7.02
CHEMBL5432183 Ki = 140.0 nM 6.85
CHEMBL5399278 Ki = 190.0 nM 6.72
CHEMBL5432345 Ki = 450.0 nM 6.35
CHEMBL5426689 Ki = 650.0 nM 6.19
CHEMBL5417206 Ki = 860.0 nM 6.07
CHEMBL5424430 Ki = 1400.0 nM 5.85
CHEMBL5409370 Ki = 1400.0 nM 5.85
CHEMBL5425170 Ki = 2100.0 nM 5.68
CHEMBL5434313 Ki = 2200.0 nM 5.66
CHEMBL5406466 Ki = 2800.0 nM 5.55
CHEMBL5411190 Ki = 3200.0 nM 5.50
CHEMBL5434023 Ki = 4100.0 nM 5.39
CHEMBL5404950 Ki = 5400.0 nM 5.27
CHEMBL5395424 Ki = 10000.0 nM 5.00
CHEMBL5395340 Ki = 11000.0 nM 4.96
CHEMBL5433740 Ki = 12000.0 nM 4.92
CHEMBL5429300 Ki = 14000.0 nM 4.85
CHEMBL5407102 Ki = 17000.0 nM 4.77
CHEMBL5414706 Ki = 21000.0 nM 4.68
CHEMBL5411538 Ki = 22000.0 nM 4.66