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Assay Detail

CHEMBL839610

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

Binding
Affinity for sigma receptor type 1 of guinea pig using [3H]ifenprodil or (+)-[3H]pentazocine radioligand
48
Total Activities
48
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Cavia porcellus
Confidence 8 — Homologous single protein target
Curated By Expert

Target

Sigma non-opioid intracellular receptor 1 (CHEMBL287)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of high-affinity ligands of sigma1 receptor, ERG2, and emopamil binding protein by pharmacophore modeling and virtual screening.
Laggner C, Schieferer C, Fiechtner B, Poles G, Hoffmann RD, Glossmann H, Langer T, Moebius FF.
J Med Chem (2005) 48 : 4754 -4764
PubMed 16033255 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 48 7.95 11.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL372700 FENPROPIMORPH 1 11.00
CHEMBL365842 1 10.40
CHEMBL54 HALOPERIDOL 4.0 1 9.70
CHEMBL370753 OPIPRAMOL 3.0 1 9.70
CHEMBL17470 1 9.30
CHEMBL361085 1 9.30
CHEMBL62540 1 9.22
CHEMBL15023 TRIFLUPERIDOL 2.0 1 9.08
CHEMBL187615 1 9.00
CHEMBL190883 1 9.00
CHEMBL365141 1 9.00
CHEMBL363884 RONIPAMIL 2.0 1 9.00
CHEMBL633 AMIODARONE 4.0 1 9.00
CHEMBL363765 1 8.89
CHEMBL305593 1 8.77
CHEMBL113830 (S,R)-IFENPRODIL 1 8.70
CHEMBL187892 1 8.60
CHEMBL190631 1 8.52
CHEMBL188476 1 8.52
CHEMBL187829 LEVEMOPAMIL 2.0 1 8.40
CHEMBL167779 ZUCLOMIPHENE 2.0 1 8.30
CHEMBL190422 1 8.30
CHEMBL365722 1 8.22
CHEMBL7393 1 8.22
CHEMBL187709 TRIPARANOL 4.0 1 8.10
CHEMBL954 ENCLOMIPHENE 3.0 1 8.10
CHEMBL422 TRIFLUOPERAZINE 4.0 1 7.82
CHEMBL282433 DITOLYLGUANIDINE 1 7.82
CHEMBL61539 1 7.80
CHEMBL28211 NAFOXIDINE 2.0 1 7.52

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL372700 FENPROPIMORPH Ki = 0.01 nM 11.00
CHEMBL365842 Ki = 0.04 nM 10.40
CHEMBL370753 OPIPRAMOL Ki = 0.2 nM 9.70
CHEMBL54 HALOPERIDOL Ki = 0.2 nM 9.70
CHEMBL17470 Ki = 0.5 nM 9.30
CHEMBL361085 Ki = 0.5 nM 9.30
CHEMBL62540 Ki = 0.6 nM 9.22
CHEMBL15023 TRIFLUPERIDOL Ki = 0.83 nM 9.08
CHEMBL187615 Ki = 1.0 nM 9.00
CHEMBL190883 Ki = 1.0 nM 9.00
CHEMBL365141 Ki = 1.0 nM 9.00
CHEMBL363884 RONIPAMIL Ki = 1.0 nM 9.00
CHEMBL633 AMIODARONE Ki = 1.0 nM 9.00
CHEMBL363765 Ki = 1.3 nM 8.89
CHEMBL305593 Ki = 1.7 nM 8.77
CHEMBL113830 (S,R)-IFENPRODIL Ki = 2.0 nM 8.70
CHEMBL187892 Ki = 2.5 nM 8.60
CHEMBL190631 Ki = 3.0 nM 8.52
CHEMBL188476 Ki = 3.0 nM 8.52
CHEMBL187829 LEVEMOPAMIL Ki = 4.0 nM 8.40
CHEMBL167779 ZUCLOMIPHENE Ki = 5.0 nM 8.30
CHEMBL190422 Ki = 5.0 nM 8.30
CHEMBL365722 Ki = 6.0 nM 8.22
CHEMBL7393 Ki = 6.0 nM 8.22
CHEMBL187709 TRIPARANOL Ki = 8.0 nM 8.10
CHEMBL954 ENCLOMIPHENE Ki = 8.0 nM 8.10
CHEMBL422 TRIFLUOPERAZINE Ki = 15.0 nM 7.82
CHEMBL282433 DITOLYLGUANIDINE Ki = 15.0 nM 7.82
CHEMBL61539 Ki = 16.0 nM 7.80
CHEMBL28211 NAFOXIDINE Ki = 30.0 nM 7.52
CHEMBL83 TAMOXIFEN Ki = 35.0 nM 7.46
CHEMBL81 RALOXIFENE Ki = 38.0 nM 7.42
CHEMBL2368401 (7S,8R)-6-ALLYLAMINO-7,8-DIMETHYL-8-PROPYL-5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-OL Ki = 40.0 nM 7.40
CHEMBL363703 Ki = 74.0 nM 7.13
CHEMBL365417 Ki = 81.0 nM 7.09
CHEMBL372484 Ki = 207.0 nM 6.68
CHEMBL188044 Ki = 230.0 nM 6.64
CHEMBL103 PROGESTERONE Ki = 260.0 nM 6.58
CHEMBL189871 Ki = 680.0 nM 6.17
CHEMBL626 NAFTIFINE Ki = 880.0 nM 6.06
CHEMBL386630 TESTOSTERONE Ki = 1200.0 nM 5.92
CHEMBL188921 BUFLOMEDIL Ki = 1290.0 nM 5.89
CHEMBL607293 Ki = 8554.0 nM 5.07
CHEMBL345754 Ki = 26700.0 nM 4.57
CHEMBL110739 CORTICOSTERONE Ki = 35600.0 nM 4.45
CHEMBL822 TERBINAFINE Ki - nM -
CHEMBL366154 Ki > 100000.0 nM -
CHEMBL186779 JERVINE Ki > 100000.0 nM -