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Assay Detail

CHEMBL4010336

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

ADMET
Inhibition of DHFR (unknown origin)
17
Total Activities
17
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Dihydrofolate reductase (CHEMBL202)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Design of Potent mRNA Decapping Scavenger Enzyme (DcpS) Inhibitors with Improved Physicochemical Properties To Investigate the Mechanism of Therapeutic Benefit in Spinal Muscular Atrophy (SMA).
Gopalsamy A, Narayanan A, Liu S, Parikh MD, Kyne RE, Fadeyi O, Tones MA, Cherry JJ, Nabhan JF, LaRosa G, Petersen DN, Menard C, Foley TL, Noell S, Ren Y, Loria PM, Maglich-Goodwin J, Rong H, Jones LH.
J Med Chem (2017) 60 : 3094 -3108
PubMed 28257199 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 17 4.96 6.20

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL398675 1 6.20
CHEMBL4084161 1 5.85
CHEMBL4075292 1 4.82
CHEMBL4090641 1 4.60
CHEMBL4068466 1 4.55
CHEMBL255019 1 4.42
CHEMBL4077061 1 4.28
CHEMBL343543 1 -
CHEMBL342595 1 -
CHEMBL250231 1 -
CHEMBL4072481 1 -
CHEMBL251906 1 -
CHEMBL4062544 1 -
CHEMBL399673 1 -
CHEMBL251428 1 -
CHEMBL268354 1 -
CHEMBL4061457 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL398675 IC50 = 630.0 nM 6.20
CHEMBL4084161 IC50 = 1400.0 nM 5.85
CHEMBL4075292 IC50 = 15000.0 nM 4.82
CHEMBL4090641 IC50 = 25000.0 nM 4.60
CHEMBL4068466 IC50 = 28000.0 nM 4.55
CHEMBL255019 IC50 = 38000.0 nM 4.42
CHEMBL4077061 IC50 = 52000.0 nM 4.28
CHEMBL343543 IC50 - -
CHEMBL342595 IC50 - -
CHEMBL250231 IC50 - -
CHEMBL4072481 IC50 - -
CHEMBL251906 IC50 > 30000.0 nM -
CHEMBL4062544 IC50 > 50000.0 nM -
CHEMBL399673 IC50 - -
CHEMBL251428 IC50 > 50000.0 nM -
CHEMBL268354 IC50 - -
CHEMBL4061457 IC50 > 150000.0 nM -