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Assay Detail

CHEMBL4432140

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

ADMET
Cytotoxicity in RFC-null Chinese hamster R2 cells assessed as reduction in cell viability measured after 96 hrs by Cell-Titer Blue fluorescence analysis
10
Total Activities
10
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Cricetulus griseus
Cell Type R2
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Tumor Targeting with Novel 6-Substituted Pyrrolo [2,3-d] Pyrimidine Antifolates with Heteroatom Bridge Substitutions via Cellular Uptake by Folate Receptor α and the Proton-Coupled Folate Transporter and Inhibition of de Novo Purine Nucleotide Biosynthesis.
Golani LK, Wallace-Povirk A, Deis SM, Wong J, Ke J, Gu X, Raghavan S, Wilson MR, Li X, Polin L, de Waal PW, White K, Kushner J, O'Connor C, Hou Z, Xu HE, Melcher K, Dann CE, Matherly LH, Gangjee A.
J Med Chem (2016) 59 : 7856 -7876
PubMed 27458733 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 10 7.22 7.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL34412 LOMETREXOL 2.0 1 7.92
CHEMBL225071 RALTITREXED 4.0 1 7.82
CHEMBL225072 PEMETREXED 4.0 1 7.38
CHEMBL34259 METHOTREXATE 4.0 1 6.94
CHEMBL4447805 1 6.03
CHEMBL4437824 1 -
CHEMBL4471269 1 -
CHEMBL4444011 1 -
CHEMBL4553188 1 -
CHEMBL4467936 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL34412 LOMETREXOL IC50 = 12.0 nM 7.92
CHEMBL225071 RALTITREXED IC50 = 15.0 nM 7.82
CHEMBL225072 PEMETREXED IC50 = 42.0 nM 7.38
CHEMBL34259 METHOTREXATE IC50 = 114.0 nM 6.94
CHEMBL4447805 IC50 = 940.0 nM 6.03
CHEMBL4437824 IC50 > 1000.0 nM -
CHEMBL4471269 IC50 > 1000.0 nM -
CHEMBL4444011 IC50 > 1000.0 nM -
CHEMBL4553188 IC50 > 1000.0 nM -
CHEMBL4467936 IC50 > 1000.0 nM -