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Assay Detail

CHEMBL4048736

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

Binding
Inhibition of human ABCG2 expressed in MDCK2 cells assessed as increase in accumulation of Hoechst 33342 preincubated for 30 mins followed by Hoechst 33342 addition measured every 60 secs for 120 mins by fluorescence assay
38
Total Activities
38
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

Publication

New Inhibitors of Breast Cancer Resistance Protein (ABCG2) Containing a 2,4-Disubstituted Pyridopyrimidine Scaffold.
Krapf MK, Gallus J, Vahdati S, Wiese M.
J Med Chem (2018) 61 : 3389 -3408
PubMed 29547272 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 38 6.15 6.83

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4072482 1 6.83
CHEMBL4070627 1 6.82
CHEMBL4063711 1 6.79
CHEMBL4077318 1 6.79
CHEMBL547193 1 6.75
CHEMBL4062196 1 6.69
CHEMBL488910 1 6.64
CHEMBL4077346 1 6.62
CHEMBL4072305 1 6.58
CHEMBL4081623 1 6.46
CHEMBL4094899 1 6.46
CHEMBL4069654 1 6.40
CHEMBL4091528 1 6.37
CHEMBL4060543 1 6.34
CHEMBL4094267 1 6.29
CHEMBL4075334 1 6.28
CHEMBL4094904 1 6.27
CHEMBL4073354 1 6.24
CHEMBL4067469 1 6.21
CHEMBL4063699 1 6.20
CHEMBL4075963 1 6.13
CHEMBL4073213 1 6.06
CHEMBL1194993 1 6.05
CHEMBL4094008 1 6.04
CHEMBL4083745 1 6.02
CHEMBL4066611 1 5.92
CHEMBL4104361 1 5.91
CHEMBL4082782 1 5.91
CHEMBL4064296 1 5.90
CHEMBL4101737 1 5.89

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4072482 IC50 = 149.0 nM 6.83
CHEMBL4070627 IC50 = 150.0 nM 6.82
CHEMBL4077318 IC50 = 164.0 nM 6.79
CHEMBL4063711 IC50 = 163.0 nM 6.79
CHEMBL547193 IC50 = 177.0 nM 6.75
CHEMBL4062196 IC50 = 206.0 nM 6.69
CHEMBL488910 IC50 = 227.0 nM 6.64
CHEMBL4077346 IC50 = 238.0 nM 6.62
CHEMBL4072305 IC50 = 264.0 nM 6.58
CHEMBL4081623 IC50 = 343.0 nM 6.46
CHEMBL4094899 IC50 = 348.0 nM 6.46
CHEMBL4069654 IC50 = 400.0 nM 6.40
CHEMBL4091528 IC50 = 425.0 nM 6.37
CHEMBL4060543 IC50 = 454.0 nM 6.34
CHEMBL4094267 IC50 = 519.0 nM 6.29
CHEMBL4075334 IC50 = 528.0 nM 6.28
CHEMBL4094904 IC50 = 539.0 nM 6.27
CHEMBL4073354 IC50 = 572.0 nM 6.24
CHEMBL4067469 IC50 = 621.0 nM 6.21
CHEMBL4063699 IC50 = 628.0 nM 6.20
CHEMBL4075963 IC50 = 747.0 nM 6.13
CHEMBL4073213 IC50 = 876.0 nM 6.06
CHEMBL1194993 IC50 = 882.0 nM 6.05
CHEMBL4094008 IC50 = 910.0 nM 6.04
CHEMBL4083745 IC50 = 963.0 nM 6.02
CHEMBL4066611 IC50 = 1210.0 nM 5.92
CHEMBL4104361 IC50 = 1230.0 nM 5.91
CHEMBL4082782 IC50 = 1230.0 nM 5.91
CHEMBL4064296 IC50 = 1260.0 nM 5.90
CHEMBL4101737 IC50 = 1300.0 nM 5.89
CHEMBL4091514 IC50 = 1530.0 nM 5.82
CHEMBL4076800 IC50 = 2040.0 nM 5.69
CHEMBL4092472 IC50 = 5270.0 nM 5.28
CHEMBL4099262 IC50 = 6400.0 nM 5.19
CHEMBL4060914 IC50 = 16900.0 nM 4.77
CHEMBL4074563 IC50 = 19500.0 nM 4.71
CHEMBL4072298 IC50 - -
CHEMBL4099250 IC50 - -