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Assay Detail

CHEMBL3767599

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

Binding
Inhibition of human SERT expressed in HEK293 cells preincubated for 30 mins followed by fluorescent substrate addition measured after 30 mins by plate reader analysis
13
Total Activities
13
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type HEK293
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Sodium-dependent serotonin transporter (CHEMBL228)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of Vibegron: A Potent and Selective β3 Adrenergic Receptor Agonist for the Treatment of Overactive Bladder.
Edmondson SD, Zhu C, Kar NF, Di Salvo J, Nagabukuro H, Sacre-Salem B, Dingley K, Berger R, Goble SD, Morriello G, Harper B, Moyes CR, Shen DM, Wang L, Ball R, Fitzmaurice A, Frenkl T, Gichuru LN, Ha S, Hurley AL, Jochnowitz N, Levorse D, Mistry S, Miller RR, Ormes J, Salituro GM, Sanfiz A, Stevenson AS, Villa K, Zamlynny B, Green S, Struthers M, Weber AE.
J Med Chem (2016) 59 : 609 -623
PubMed 26709102 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 13 5.87 6.70

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3764774 1 6.70
CHEMBL3128178 1 6.38
CHEMBL3764950 1 6.16
CHEMBL3763998 1 6.10
CHEMBL3128188 1 6.05
CHEMBL3764592 1 5.96
CHEMBL1684585 1 5.85
CHEMBL3763594 1 5.60
CHEMBL3764088 1 5.36
CHEMBL111201 1 5.30
CHEMBL3763934 1 5.15
CHEMBL3765335 1 -
CHEMBL2107826 VIBEGRON 4.0 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3764774 IC50 = 200.0 nM 6.70
CHEMBL3128178 IC50 = 420.0 nM 6.38
CHEMBL3764950 IC50 = 700.0 nM 6.16
CHEMBL3763998 IC50 = 800.0 nM 6.10
CHEMBL3128188 IC50 = 900.0 nM 6.05
CHEMBL3764592 IC50 = 1100.0 nM 5.96
CHEMBL1684585 IC50 = 1400.0 nM 5.85
CHEMBL3763594 IC50 = 2500.0 nM 5.60
CHEMBL3764088 IC50 = 4400.0 nM 5.36
CHEMBL111201 IC50 = 5000.0 nM 5.30
CHEMBL3763934 IC50 = 7100.0 nM 5.15
CHEMBL3765335 IC50 > 10000.0 nM -
CHEMBL2107826 VIBEGRON IC50 > 10000.0 nM -