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Assay Detail

CHEMBL1051044

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Binding
Inhibition of SERT
22
Total Activities
22
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Intermediate

Target

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

Publication

Novel, achiral aminoheterocycles as selective monoamine reuptake inhibitors.
Lucas MC, Carter DS, Cai HY, Lee EK, Schoenfeld RC, Steiner S, Villa M, Weikert RJ, Iyer PS.
Bioorg Med Chem Lett (2009) 19 : 4630 -4633
PubMed 19592243 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 22 8.16 9.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL570317 1 9.60
CHEMBL1175 DULOXETINE 4.0 1 9.30
CHEMBL560535 1 9.10
CHEMBL564094 1 8.90
CHEMBL561598 1 8.90
CHEMBL550870 1 8.80
CHEMBL551818 1 8.70
CHEMBL564285 1 8.60
CHEMBL550469 1 8.40
CHEMBL557119 1 8.40
CHEMBL552938 1 8.40
CHEMBL552341 1 8.20
CHEMBL564288 1 8.20
CHEMBL560536 1 8.20
CHEMBL556714 1 7.90
CHEMBL551135 1 7.70
CHEMBL555565 1 7.60
CHEMBL556299 1 7.50
CHEMBL561599 1 7.40
CHEMBL571893 1 7.40
CHEMBL550932 1 6.40
CHEMBL559137 1 6.00

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL570317 Ki = 0.2512 nM 9.60
CHEMBL1175 DULOXETINE Ki = 0.5012 nM 9.30
CHEMBL560535 Ki = 0.7943 nM 9.10
CHEMBL564094 Ki = 1.259 nM 8.90
CHEMBL561598 Ki = 1.259 nM 8.90
CHEMBL550870 Ki = 1.585 nM 8.80
CHEMBL551818 Ki = 1.995 nM 8.70
CHEMBL564285 Ki = 2.512 nM 8.60
CHEMBL550469 Ki = 3.981 nM 8.40
CHEMBL557119 Ki = 3.981 nM 8.40
CHEMBL552938 Ki = 3.981 nM 8.40
CHEMBL552341 Ki = 6.31 nM 8.20
CHEMBL564288 Ki = 6.31 nM 8.20
CHEMBL560536 Ki = 6.31 nM 8.20
CHEMBL556714 Ki = 12.59 nM 7.90
CHEMBL551135 Ki = 19.95 nM 7.70
CHEMBL555565 Ki = 25.12 nM 7.60
CHEMBL556299 Ki = 31.62 nM 7.50
CHEMBL561599 Ki = 39.81 nM 7.40
CHEMBL571893 Ki = 39.81 nM 7.40
CHEMBL550932 Ki = 398.11 nM 6.40
CHEMBL559137 Ki = 1000.0 nM 6.00