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Assay Detail

CHEMBL853390

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

Binding
Inhibition of DAT-mediated [3H]DA uptake in rat striatum
15
Total Activities
15
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Rattus norvegicus
Tissue Striatum
Confidence 9 — Direct single protein target
Curated By Expert

Target

Sodium-dependent dopamine transporter (CHEMBL338)
Type SINGLE PROTEIN
Organism Rattus norvegicus

Publication

Further structural exploration of trisubstituted asymmetric pyran derivatives (2S,4R,5R)-2-benzhydryl-5-benzylamino-tetrahydropyran-4-ol and their corresponding disubstituted (3S,6S) pyran derivatives: a proposed pharmacophore model for high-affinity interaction with the dopamine, serotonin, and norepinephrine transporters.
Zhang S, Fernandez F, Hazeldine S, Deschamps J, Zhen J, Reith ME, Dutta AK.
J Med Chem (2006) 49 : 4239 -4247
PubMed 16821783 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 15 7.05 7.97

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL281594 VANOXERINE 3.0 1 7.97
CHEMBL211302 1 7.46
CHEMBL209843 1 7.36
CHEMBL209651 1 7.22
CHEMBL213627 1 7.21
CHEMBL209809 1 7.17
CHEMBL211077 1 7.07
CHEMBL379706 1 7.04
CHEMBL211484 1 6.94
CHEMBL209808 1 6.92
CHEMBL378437 1 6.85
CHEMBL211994 1 6.76
CHEMBL379716 1 6.74
CHEMBL209603 1 6.67
CHEMBL377129 1 6.35

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL281594 VANOXERINE Ki = 10.6 nM 7.97
CHEMBL211302 Ki = 34.6 nM 7.46
CHEMBL209843 Ki = 43.9 nM 7.36
CHEMBL209651 Ki = 59.9 nM 7.22
CHEMBL213627 Ki = 62.4 nM 7.21
CHEMBL209809 Ki = 67.4 nM 7.17
CHEMBL211077 Ki = 85.0 nM 7.07
CHEMBL379706 Ki = 91.5 nM 7.04
CHEMBL211484 Ki = 115.0 nM 6.94
CHEMBL209808 Ki = 120.0 nM 6.92
CHEMBL378437 Ki = 142.0 nM 6.85
CHEMBL211994 Ki = 172.0 nM 6.76
CHEMBL379716 Ki = 184.0 nM 6.74
CHEMBL209603 Ki = 214.0 nM 6.67
CHEMBL377129 Ki = 446.0 nM 6.35