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Assay Detail

CHEMBL2350909

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

Binding
Displacement of [3H](+)-Pentazocine from sigma 1 receptor in guinea pig brain membranes after 120 mins by scintillation counting analysis
32
Total Activities
32
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Cavia porcellus
Tissue Brain
Subcellular Membrane
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Sigma non-opioid intracellular receptor 1 (CHEMBL4153)
Type SINGLE PROTEIN
Organism Cavia porcellus

Publication

Improvement of σ1 receptor affinity by late-stage C-H-bond arylation of spirocyclic lactones.
Meyer C, Neue B, Schepmann D, Yanagisawa S, Yamaguchi J, Würthwein EU, Itami K, Wünsch B.
Bioorg Med Chem (2013) 21 : 1844 -1856
PubMed 23462714 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 32 7.45 8.96

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL138809 1 8.96
CHEMBL141209 1 8.89
CHEMBL2349454 1 8.60
CHEMBL2349459 1 8.28
CHEMBL2349446 1 8.28
CHEMBL60542 (+)-PENTAZOCINE 1 8.24
CHEMBL54 HALOPERIDOL 4.0 1 8.20
CHEMBL2349443 1 8.20
CHEMBL2349441 1 8.05
CHEMBL2349455 1 7.96
CHEMBL2349456 1 7.96
CHEMBL2349461 1 7.96
CHEMBL2349453 1 7.80
CHEMBL343793 1 7.68
CHEMBL2349458 1 7.64
CHEMBL138286 1 7.54
CHEMBL2346692 1 7.40
CHEMBL2349460 1 7.37
CHEMBL2349555 1 7.06
CHEMBL282433 DITOLYLGUANIDINE 1 7.05
CHEMBL2349457 1 6.97
CHEMBL2349442 1 6.80
CHEMBL2349444 1 6.72
CHEMBL2349452 1 6.59
CHEMBL2349450 1 6.40
CHEMBL2349554 1 6.32
CHEMBL2349447 1 6.19
CHEMBL103 PROGESTERONE 4.0 1 6.18
CHEMBL2349448 1 6.11
CHEMBL2349449 1 6.11

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL138809 Ki = 1.1 nM 8.96
CHEMBL141209 Ki = 1.3 nM 8.89
CHEMBL2349454 Ki = 2.5 nM 8.60
CHEMBL2349459 Ki = 5.3 nM 8.28
CHEMBL2349446 Ki = 5.3 nM 8.28
CHEMBL60542 (+)-PENTAZOCINE Ki = 5.7 nM 8.24
CHEMBL54 HALOPERIDOL Ki = 6.3 nM 8.20
CHEMBL2349443 Ki = 6.3 nM 8.20
CHEMBL2349441 Ki = 9.0 nM 8.05
CHEMBL2349455 Ki = 11.0 nM 7.96
CHEMBL2349456 Ki = 11.0 nM 7.96
CHEMBL2349461 Ki = 11.0 nM 7.96
CHEMBL2349453 Ki = 16.0 nM 7.80
CHEMBL343793 Ki = 21.0 nM 7.68
CHEMBL2349458 Ki = 23.0 nM 7.64
CHEMBL138286 Ki = 29.0 nM 7.54
CHEMBL2346692 Ki = 40.0 nM 7.40
CHEMBL2349460 Ki = 43.0 nM 7.37
CHEMBL2349555 Ki = 87.0 nM 7.06
CHEMBL282433 DITOLYLGUANIDINE Ki = 89.0 nM 7.05
CHEMBL2349457 Ki = 108.0 nM 6.97
CHEMBL2349442 Ki = 158.0 nM 6.80
CHEMBL2349444 Ki = 190.0 nM 6.72
CHEMBL2349452 Ki = 255.0 nM 6.59
CHEMBL2349450 Ki = 402.0 nM 6.40
CHEMBL2349554 Ki = 483.0 nM 6.32
CHEMBL2349447 Ki = 639.0 nM 6.19
CHEMBL103 PROGESTERONE Ki = 661.0 nM 6.18
CHEMBL2349448 Ki = 784.0 nM 6.11
CHEMBL2349449 Ki = 777.0 nM 6.11
CHEMBL2349451 Ki > 1000.0 nM -
CHEMBL2349445 Ki > 1000.0 nM -