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Assay Detail

CHEMBL1687396

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

Binding
Inhibition of MDR1 expressed in MDCK cells using rhodamine 123 staining by flow cytometry
16
Total Activities
16
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Cell Type MDCK
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

ATP-dependent translocase ABCB1 (CHEMBL4302)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-activity relationships of flavonoids as inhibitors of breast cancer resistance protein (BCRP).
Pick A, Müller H, Mayer R, Haenisch B, Pajeva IK, Weigt M, Bönisch H, Müller CE, Wiese M.
Bioorg Med Chem (2011) 19 : 2090 -2102
PubMed 21354800 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 16 4.93 6.68

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL348475 TARIQUIDAR 3.0 1 6.68
CHEMBL1685073 1 5.85
CHEMBL1685072 NEOCALYCOPTERON 1 5.10
CHEMBL1685074 CALYFLORENON B 1 5.10
CHEMBL6966 VERAPAMIL 4.0 1 5.01
CHEMBL74898 AYANIN 1 4.89
CHEMBL165509 PENDULETIN 1 4.85
CHEMBL1685068 DIMETHYLCRYPTOSTROBIN 1 4.82
CHEMBL137586 6-METHOXYFLAVONE 1 4.82
CHEMBL77966 RETUSIN 1 4.80
CHEMBL1685069 Strobochrysin-dimethylether 1 4.72
CHEMBL1685067 STROBOPININ-7-METHYLETHER 1 4.54
CHEMBL226507 SINENSETIN 1 4.54
CHEMBL77993 3,5,6,7,8,3',4'-HEPTAMETHOXYFLAVONE 1 4.51
CHEMBL73930 TANGERETIN 1 4.41
CHEMBL476292 1 4.19

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL348475 TARIQUIDAR IC50 = 210.0 nM 6.68
CHEMBL1685073 IC50 = 1400.0 nM 5.85
CHEMBL1685072 NEOCALYCOPTERON IC50 = 8000.0 nM 5.10
CHEMBL1685074 CALYFLORENON B IC50 = 8000.0 nM 5.10
CHEMBL6966 VERAPAMIL IC50 = 9800.0 nM 5.01
CHEMBL74898 AYANIN IC50 = 13000.0 nM 4.89
CHEMBL165509 PENDULETIN IC50 = 14000.0 nM 4.85
CHEMBL1685068 DIMETHYLCRYPTOSTROBIN IC50 = 15000.0 nM 4.82
CHEMBL137586 6-METHOXYFLAVONE IC50 = 15000.0 nM 4.82
CHEMBL77966 RETUSIN IC50 = 16000.0 nM 4.80
CHEMBL1685069 Strobochrysin-dimethylether IC50 = 19000.0 nM 4.72
CHEMBL1685067 STROBOPININ-7-METHYLETHER IC50 = 29000.0 nM 4.54
CHEMBL226507 SINENSETIN IC50 = 29000.0 nM 4.54
CHEMBL77993 3,5,6,7,8,3',4'-HEPTAMETHOXYFLAVONE IC50 = 31000.0 nM 4.51
CHEMBL73930 TANGERETIN IC50 = 39000.0 nM 4.41
CHEMBL476292 IC50 = 64000.0 nM 4.19