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Assay Detail

CHEMBL1647747

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

Binding
Inhibition of [3H]dopamine uptake at human DAT expressed in mouse N2A cells
9
Total Activities
9
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type N2a
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Sodium-dependent dopamine transporter (CHEMBL238)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Azido-iodo-N-benzyl derivatives of threo-methylphenidate (Ritalin, Concerta): Rational design, synthesis, pharmacological evaluation, and dopamine transporter photoaffinity labeling.
Lapinsky DJ, Velagaleti R, Yarravarapu N, Liu Y, Huang Y, Surratt CK, Lever JR, Foster JD, Acharya R, Vaughan RA, Deutsch HM.
Bioorg Med Chem (2011) 19 : 504 -512
PubMed 21129986 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 9 6.20 7.96

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1253735 1 7.96
CHEMBL1641691 1 7.85
CHEMBL827 DEXMETHYLPHENIDATE 4.0 1 6.81
CHEMBL1641694 1 5.91
CHEMBL1641695 1 5.74
CHEMBL1641697 1 5.57
CHEMBL1641692 1 5.56
CHEMBL1641696 1 5.33
CHEMBL1641693 1 5.10

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1253735 IC50 = 11.0 nM 7.96
CHEMBL1641691 IC50 = 14.0 nM 7.85
CHEMBL827 DEXMETHYLPHENIDATE IC50 = 156.0 nM 6.81
CHEMBL1641694 IC50 = 1232.0 nM 5.91
CHEMBL1641695 IC50 = 1828.0 nM 5.74
CHEMBL1641697 IC50 = 2696.0 nM 5.57
CHEMBL1641692 IC50 = 2764.0 nM 5.56
CHEMBL1641696 IC50 = 4627.0 nM 5.33
CHEMBL1641693 IC50 = 7966.0 nM 5.10