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Assay Detail

CHEMBL899757

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

ADMET
Inhibition of microsomal CYP3A4
42
Total Activities
42
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Confidence 8 — Homologous single protein target
Curated By Intermediate

Target

Cytochrome P450 3A4 (CHEMBL340)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Pyrrolidinones as potent functional antagonists of the human melanocortin-4 receptor.
Jiang W, Tucci FC, Tran JA, Fleck BA, Wen J, Markison S, Marinkovic D, Chen CW, Arellano M, Hoare SR, Johns M, Foster AC, Saunders J, Chen C.
Bioorg Med Chem Lett (2007) 17 : 5610 -5613
PubMed 17822895 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 42 5.34 6.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL391914 1 6.92
CHEMBL236731 1 6.77
CHEMBL236732 1 6.66
CHEMBL237147 1 6.32
CHEMBL237365 1 6.19
CHEMBL391915 1 6.19
CHEMBL393789 1 6.14
CHEMBL397582 1 5.89
CHEMBL236939 1 5.72
CHEMBL235640 1 5.64
CHEMBL237146 1 5.57
CHEMBL391028 1 5.54
CHEMBL262321 1 5.54
CHEMBL397583 1 5.47
CHEMBL237578 1 5.47
CHEMBL412023 1 5.44
CHEMBL235421 1 5.44
CHEMBL393204 1 5.32
CHEMBL393576 1 5.31
CHEMBL396434 1 5.28
CHEMBL397581 1 5.27
CHEMBL236521 1 5.22
CHEMBL236519 1 5.20
CHEMBL236520 1 5.19
CHEMBL441136 1 5.19
CHEMBL397580 1 5.17
CHEMBL397584 1 5.16
CHEMBL397367 1 5.07
CHEMBL237364 1 5.05
CHEMBL237577 1 4.96

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL391914 IC50 = 120.0 nM 6.92
CHEMBL236731 IC50 = 170.0 nM 6.77
CHEMBL236732 IC50 = 220.0 nM 6.66
CHEMBL237147 IC50 = 480.0 nM 6.32
CHEMBL237365 IC50 = 650.0 nM 6.19
CHEMBL391915 IC50 = 640.0 nM 6.19
CHEMBL393789 IC50 = 720.0 nM 6.14
CHEMBL397582 IC50 = 1300.0 nM 5.89
CHEMBL236939 IC50 = 1900.0 nM 5.72
CHEMBL235640 IC50 = 2300.0 nM 5.64
CHEMBL237146 IC50 = 2700.0 nM 5.57
CHEMBL262321 IC50 = 2900.0 nM 5.54
CHEMBL391028 IC50 = 2900.0 nM 5.54
CHEMBL397583 IC50 = 3400.0 nM 5.47
CHEMBL237578 IC50 = 3400.0 nM 5.47
CHEMBL412023 IC50 = 3600.0 nM 5.44
CHEMBL235421 IC50 = 3600.0 nM 5.44
CHEMBL393204 IC50 = 4800.0 nM 5.32
CHEMBL393576 IC50 = 4900.0 nM 5.31
CHEMBL396434 IC50 = 5300.0 nM 5.28
CHEMBL397581 IC50 = 5400.0 nM 5.27
CHEMBL236521 IC50 = 6000.0 nM 5.22
CHEMBL236519 IC50 = 6300.0 nM 5.20
CHEMBL236520 IC50 = 6400.0 nM 5.19
CHEMBL441136 IC50 = 6500.0 nM 5.19
CHEMBL397580 IC50 = 6700.0 nM 5.17
CHEMBL397584 IC50 = 6900.0 nM 5.16
CHEMBL397367 IC50 = 8600.0 nM 5.07
CHEMBL237364 IC50 = 8900.0 nM 5.05
CHEMBL237577 IC50 = 11000.0 nM 4.96
CHEMBL412024 IC50 = 15000.0 nM 4.82
CHEMBL438683 IC50 = 15000.0 nM 4.82
CHEMBL396186 IC50 = 15000.0 nM 4.82
CHEMBL393788 IC50 = 16000.0 nM 4.80
CHEMBL235955 IC50 = 21000.0 nM 4.68
CHEMBL262320 IC50 = 25000.0 nM 4.60
CHEMBL397368 IC50 = 28000.0 nM 4.55
CHEMBL396431 IC50 = 32000.0 nM 4.50
CHEMBL396884 IC50 = 35000.0 nM 4.46
CHEMBL396432 IC50 = 37000.0 nM 4.43
CHEMBL236940 IC50 = 49000.0 nM 4.31
CHEMBL396433 IC50 > 50000.0 nM -