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Assay Detail

CHEMBL5161735

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

Binding
Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as substrate preincubated for 60 mins followed by substrate addition and measured after 60 mins in presence of ATP
16
Total Activities
16
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type Sf9
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

S-adenosylmethionine synthase isoform type-2 (CHEMBL3313835)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Leveraging Structure-Based Drug Design to Identify Next-Generation MAT2A Inhibitors, Including Brain-Penetrant and Peripherally Efficacious Leads.
Li M, Konteatis Z, Nagaraja N, Chen Y, Zhou S, Ma G, Gross S, Marjon K, Hyer ML, Mandley E, Lein M, Padyana AK, Jin L, Tong S, Peters R, Murtie J, Travins J, Medeiros M, Liu P, Frank V, Judd ET, Biller SA, Marks KM, Sui Z, Reznik SK.
J Med Chem (2022) 65 : 4600 -4615
PubMed 35293760 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 16 6.38 7.66

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5170690 1 7.66
CHEMBL5206904 1 7.47
CHEMBL5176577 1 7.32
CHEMBL5180626 1 7.27
CHEMBL5188451 1 6.60
CHEMBL5196666 1 6.50
CHEMBL5175314 1 6.49
CHEMBL5183201 1 6.39
CHEMBL5183797 1 6.29
CHEMBL5184221 1 6.28
CHEMBL5201203 1 6.21
CHEMBL5198564 1 6.16
CHEMBL5177072 1 5.70
CHEMBL5181922 1 5.48
CHEMBL5185744 1 5.14
CHEMBL5187600 1 5.11

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5170690 IC50 = 22.0 nM 7.66
CHEMBL5206904 IC50 = 34.0 nM 7.47
CHEMBL5176577 IC50 = 48.0 nM 7.32
CHEMBL5180626 IC50 = 54.0 nM 7.27
CHEMBL5188451 IC50 = 250.0 nM 6.60
CHEMBL5196666 IC50 = 320.0 nM 6.50
CHEMBL5175314 IC50 = 325.0 nM 6.49
CHEMBL5183201 IC50 = 410.0 nM 6.39
CHEMBL5183797 IC50 = 510.0 nM 6.29
CHEMBL5184221 IC50 = 530.0 nM 6.28
CHEMBL5201203 IC50 = 610.0 nM 6.21
CHEMBL5198564 IC50 = 690.0 nM 6.16
CHEMBL5177072 IC50 = 2010.0 nM 5.70
CHEMBL5181922 IC50 = 3310.0 nM 5.48
CHEMBL5185744 IC50 = 7200.0 nM 5.14
CHEMBL5187600 IC50 = 7830.0 nM 5.11