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Assay Detail

CHEMBL904953

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

Binding
Displacement of [3H]citalopram from 5HTT in Sprague-Dawley rat cerebrum
18
Total Activities
18
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Sodium-dependent serotonin transporter (CHEMBL313)
Type SINGLE PROTEIN
Organism Rattus norvegicus

Publication

Synthesis and pharmacology of site-specific cocaine abuse treatment agents: restricted rotation analogues of methylphenidate.
Kim DI, Deutsch HM, Ye X, Schweri MM.
J Med Chem (2007) 50 : 2718 -2731
PubMed 17489581 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 18 6.15 6.99

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL559186 1 6.99
CHEMBL556365 1 6.92
CHEMBL558182 1 6.78
CHEMBL534501 1 6.70
CHEMBL541896 1 6.61
CHEMBL537653 1 6.56
CHEMBL558395 1 6.54
CHEMBL529437 COCAINE HYDROCHLORIDE 4.0 1 6.51
CHEMBL541895 1 6.37
CHEMBL54134 1 6.18
CHEMBL537429 1 5.74
CHEMBL537652 1 5.69
CHEMBL537874 1 5.68
CHEMBL537875 1 5.62
CHEMBL537654 1 5.59
CHEMBL541898 1 5.45
CHEMBL553714 1 5.45
CHEMBL537206 1 5.29

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL559186 Ki = 102.0 nM 6.99
CHEMBL556365 Ki = 121.0 nM 6.92
CHEMBL558182 Ki = 168.0 nM 6.78
CHEMBL534501 Ki = 199.0 nM 6.70
CHEMBL541896 Ki = 243.0 nM 6.61
CHEMBL537653 Ki = 276.0 nM 6.56
CHEMBL558395 Ki = 286.0 nM 6.54
CHEMBL529437 COCAINE HYDROCHLORIDE Ki = 306.0 nM 6.51
CHEMBL541895 Ki = 427.0 nM 6.37
CHEMBL54134 Ki = 667.0 nM 6.18
CHEMBL537429 Ki = 1840.0 nM 5.74
CHEMBL537652 Ki = 2050.0 nM 5.69
CHEMBL537874 Ki = 2070.0 nM 5.68
CHEMBL537875 Ki = 2390.0 nM 5.62
CHEMBL537654 Ki = 2570.0 nM 5.59
CHEMBL541898 Ki = 3550.0 nM 5.45
CHEMBL553714 Ki = 3550.0 nM 5.45
CHEMBL537206 Ki = 5140.0 nM 5.29