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Assay Detail

CHEMBL668100

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

Binding
Inhibitory activity against cell free dihydrofolate reductase (DHFR) from Candida albicans
43
Total Activities
43
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Candida albicans
Confidence 9 — Direct single protein target
Curated By Expert

Target

Dihydrofolate reductase (CHEMBL2329)
Type SINGLE PROTEIN
Organism Candida albicans

Publication

Folate-synthesizing enzyme system as target for development of inhibitors and inhibitor combinations against Candida albicans-synthesis and biological activity of new 2,4-diaminopyrimidines and 4'-substituted 4-aminodiphenyl sulfones.
Otzen T, Wempe EG, Kunz B, Bartels R, Lehwark-Yvetot G, Hänsel W, Schaper KJ, Seydel JK.
J Med Chem (2004) 47 : 240 -253
PubMed 14695838 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 43 5.59 7.58

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL30938 1 7.58
CHEMBL426584 1 7.51
CHEMBL176848 1 7.33
CHEMBL369645 1 7.21
CHEMBL367882 1 7.11
CHEMBL368735 1 6.54
CHEMBL425506 1 6.47
CHEMBL426768 1 6.37
CHEMBL368759 1 6.36
CHEMBL177408 1 6.31
CHEMBL367220 1 6.27
CHEMBL175017 1 6.24
CHEMBL174954 1 6.21
CHEMBL175752 1 6.14
CHEMBL176217 1 6.01
CHEMBL180585 1 5.91
CHEMBL175577 1 5.87
CHEMBL177796 1 5.86
CHEMBL174633 1 5.73
CHEMBL174617 1 5.55
CHEMBL367308 1 5.51
CHEMBL361101 1 5.47
CHEMBL362254 1 5.43
CHEMBL176882 1 5.38
CHEMBL177125 1 5.32
CHEMBL362208 1 5.24
CHEMBL368065 1 5.21
CHEMBL369501 1 5.18
CHEMBL435553 1 5.10
CHEMBL175747 1 5.00

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL30938 IC50 = 26.0 nM 7.58
CHEMBL426584 IC50 = 31.0 nM 7.51
CHEMBL176848 IC50 = 47.0 nM 7.33
CHEMBL369645 IC50 = 61.0 nM 7.21
CHEMBL367882 IC50 = 78.0 nM 7.11
CHEMBL368735 IC50 = 290.0 nM 6.54
CHEMBL425506 IC50 = 340.0 nM 6.47
CHEMBL426768 IC50 = 430.0 nM 6.37
CHEMBL368759 IC50 = 435.0 nM 6.36
CHEMBL177408 IC50 = 490.0 nM 6.31
CHEMBL367220 IC50 = 538.0 nM 6.27
CHEMBL175017 IC50 = 581.0 nM 6.24
CHEMBL174954 IC50 = 619.0 nM 6.21
CHEMBL175752 IC50 = 730.0 nM 6.14
CHEMBL176217 IC50 = 970.0 nM 6.01
CHEMBL180585 IC50 = 1240.0 nM 5.91
CHEMBL175577 IC50 = 1340.0 nM 5.87
CHEMBL177796 IC50 = 1390.0 nM 5.86
CHEMBL174633 IC50 = 1850.0 nM 5.73
CHEMBL174617 IC50 = 2810.0 nM 5.55
CHEMBL367308 IC50 = 3100.0 nM 5.51
CHEMBL361101 IC50 = 3370.0 nM 5.47
CHEMBL362254 IC50 = 3720.0 nM 5.43
CHEMBL176882 IC50 = 4200.0 nM 5.38
CHEMBL177125 IC50 = 4770.0 nM 5.32
CHEMBL362208 IC50 = 5720.0 nM 5.24
CHEMBL368065 IC50 = 6129.0 nM 5.21
CHEMBL369501 IC50 = 6630.0 nM 5.18
CHEMBL435553 IC50 = 7940.0 nM 5.10
CHEMBL175747 IC50 = 9900.0 nM 5.00
CHEMBL174753 IC50 = 13900.0 nM 4.86
CHEMBL177862 IC50 = 16100.0 nM 4.79
CHEMBL426950 IC50 = 23800.0 nM 4.62
CHEMBL174679 IC50 = 26100.0 nM 4.58
CHEMBL22 TRIMETHOPRIM IC50 = 30300.0 nM 4.52
CHEMBL425152 IC50 = 30900.0 nM 4.51
CHEMBL177819 IC50 = 35400.0 nM 4.45
CHEMBL369237 IC50 = 52300.0 nM 4.28
CHEMBL366989 IC50 = 53460.0 nM 4.27
CHEMBL177230 IC50 = 59400.0 nM 4.23
CHEMBL174223 IC50 = 84800.0 nM 4.07
CHEMBL265493 IC50 = 90450.0 nM 4.04
CHEMBL177511 IC50 = 125800.0 nM -