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Assay Detail

CHEMBL4606697

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

Binding
Inhibition of human recombinant DNMT3B expressed in baculovirus infected insect cells using CpG site containing internally quenched hairpin oligonucleotide DNA substrate and SAM incubated for 30 mins by kinetic fluorogenic assay
21
Total Activities
21
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

DNA (cytosine-5)-methyltransferase 3B (CHEMBL6095)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-Guided Identification of DNMT3B Inhibitors.
Newton AS, Faver JC, Micevic G, Muthusamy V, Kudalkar SN, Bertoletti N, Anderson KS, Bosenberg MW, Jorgensen WL.
ACS Med Chem Lett (2020) 11 : 971 -976
PubMed 32435413 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 21 4.74 6.05

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1564869 1 6.05
CHEMBL2106789 NANAFROCIN 2.0 1 5.82
CHEMBL4645141 1 5.10
CHEMBL4634562 1 5.00
CHEMBL4647360 1 4.96
CHEMBL4640870 1 4.87
CHEMBL4642475 1 4.65
CHEMBL4647309 1 4.55
CHEMBL4642377 1 4.43
CHEMBL4637965 1 4.35
CHEMBL4647111 1 4.17
CHEMBL4641323 1 4.15
CHEMBL4632355 1 4.14
CHEMBL4644275 1 4.10
CHEMBL4638087 1 -
CHEMBL4632946 1 -
CHEMBL4647636 1 -
CHEMBL4637495 1 -
CHEMBL4633225 1 -
CHEMBL4638518 1 -
CHEMBL4636284 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1564869 IC50 = 900.0 nM 6.05
CHEMBL2106789 NANAFROCIN IC50 = 1500.0 nM 5.82
CHEMBL4645141 IC50 = 8000.0 nM 5.10
CHEMBL4634562 IC50 = 10000.0 nM 5.00
CHEMBL4647360 IC50 = 11000.0 nM 4.96
CHEMBL4640870 IC50 = 13500.0 nM 4.87
CHEMBL4642475 IC50 = 22400.0 nM 4.65
CHEMBL4647309 IC50 = 28000.0 nM 4.55
CHEMBL4642377 IC50 = 37200.0 nM 4.43
CHEMBL4637965 IC50 = 45000.0 nM 4.35
CHEMBL4647111 IC50 = 66800.0 nM 4.17
CHEMBL4641323 IC50 = 70400.0 nM 4.15
CHEMBL4632355 IC50 = 72300.0 nM 4.14
CHEMBL4644275 IC50 = 80000.0 nM 4.10
CHEMBL4638087 IC50 - -
CHEMBL4632946 IC50 - -
CHEMBL4647636 IC50 - -
CHEMBL4637495 IC50 - -
CHEMBL4633225 IC50 - -
CHEMBL4638518 IC50 - -
CHEMBL4636284 IC50 - -