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Assay Detail

CHEMBL948141

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Binding
Inhibition of NET mediated norepinephrine uptake
25
Total Activities
23
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Sodium-dependent noradrenaline transporter (CHEMBL222)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

In vitro and in vivo evaluation of O-alkyl derivatives of tramadol.
Shao L, Hewitt M, Jerussi TP, Wu F, Malcolm S, Grover P, Fang K, Koch P, Senanayake C, Bhongle N, Ribe S, Bakale R, Currie M.
Bioorg Med Chem Lett (2008) 18 : 1674 -1680
PubMed 18242987 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 25 5.59 6.79

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL272533 1 6.79
CHEMBL270642 1 6.28
CHEMBL256163 1 6.05
CHEMBL403388 1 6.00
CHEMBL258336 2 5.82
CHEMBL258338 1 5.80
CHEMBL402116 2 5.65
CHEMBL404197 1 5.42
CHEMBL272063 1 5.42
CHEMBL256227 1 5.41
CHEMBL1237044 TRAMADOL 4.0 1 5.41
CHEMBL256902 1 5.41
CHEMBL257083 1 5.41
CHEMBL255196 1 5.35
CHEMBL257264 1 5.23
CHEMBL270786 1 5.20
CHEMBL258140 1 5.17
CHEMBL407563 1 5.05
CHEMBL270570 1 -
CHEMBL255768 1 -
CHEMBL257265 1 -
CHEMBL256371 1 -
CHEMBL1400 O-DESMETHYL TRAMADOL 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL272533 IC50 = 161.0 nM 6.79
CHEMBL270642 IC50 = 525.0 nM 6.28
CHEMBL256163 IC50 = 898.0 nM 6.05
CHEMBL403388 IC50 = 1010.0 nM 6.00
CHEMBL258336 IC50 = 1518.0 nM 5.82
CHEMBL258338 IC50 = 1565.0 nM 5.80
CHEMBL402116 IC50 = 2250.0 nM 5.65
CHEMBL404197 IC50 = 3776.0 nM 5.42
CHEMBL258336 IC50 = 3789.0 nM 5.42
CHEMBL272063 IC50 = 3776.0 nM 5.42
CHEMBL256902 IC50 = 3861.0 nM 5.41
CHEMBL1237044 TRAMADOL IC50 = 3861.0 nM 5.41
CHEMBL257083 IC50 = 3873.0 nM 5.41
CHEMBL256227 IC50 = 3867.0 nM 5.41
CHEMBL255196 IC50 = 4495.0 nM 5.35
CHEMBL257264 IC50 = 5948.0 nM 5.23
CHEMBL270786 IC50 = 6248.0 nM 5.20
CHEMBL258140 IC50 = 6688.0 nM 5.17
CHEMBL407563 IC50 = 8999.0 nM 5.05
CHEMBL270570 IC50 > 10000.0 nM -
CHEMBL255768 IC50 > 10000.0 nM -
CHEMBL257265 IC50 > 10000.0 nM -
CHEMBL256371 IC50 > 10000.0 nM -
CHEMBL402116 IC50 > 10000.0 nM -
CHEMBL1400 O-DESMETHYL TRAMADOL IC50 > 10000.0 nM -