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Assay Detail

CHEMBL5520730

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

Binding
Inhibition of P-gp efflux in MDCKII-MDR1 cells using calcein-AM as substrate assessed as intracellular calcein fluorescence preincubated for 15 mins followed by substrate addition and measured by fluorescence based assay
13
Total Activities
13
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Canis lupus familiaris
Cell Type MDCKII-MDR1
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Hit-to-Lead Identification and Validation of a Triaromatic Pleuromutilin Antibiotic Candidate.
Heidtmann CV, Fejer AR, Stærk K, Pedersen M, Asmussen MG, Hertz FB, Prabhala BK, Frimodt-Møller N, Klitgaard JK, Andersen TE, Nielsen CU, Nielsen P.
J Med Chem (2024) 67 : 3692 -3710
PubMed 38385364 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 13 4.57 5.70

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4744370 1 5.70
CHEMBL5523552 1 5.16
CHEMBL5560546 1 5.00
CHEMBL4746064 1 4.44
CHEMBL3291398 LEFAMULIN 4.0 1 4.37
CHEMBL5559113 1 4.34
CHEMBL5561773 1 4.33
CHEMBL5560022 1 4.30
CHEMBL5565180 1 4.09
CHEMBL5559456 1 4.01
CHEMBL5563824 1 -
CHEMBL5555635 1 -
CHEMBL5557915 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4744370 IC50 = 2000.0 nM 5.70
CHEMBL5523552 IC50 = 7000.0 nM 5.16
CHEMBL5560546 IC50 = 10000.0 nM 5.00
CHEMBL4746064 IC50 = 36000.0 nM 4.44
CHEMBL3291398 LEFAMULIN IC50 = 43000.0 nM 4.37
CHEMBL5559113 IC50 = 46000.0 nM 4.34
CHEMBL5561773 IC50 = 47000.0 nM 4.33
CHEMBL5560022 IC50 = 50000.0 nM 4.30
CHEMBL5565180 IC50 = 81000.0 nM 4.09
CHEMBL5559456 IC50 = 98000.0 nM 4.01
CHEMBL5563824 IC50 > 100000.0 nM -
CHEMBL5555635 IC50 > 100000.0 nM -
CHEMBL5557915 IC50 - -