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Assay Detail

CHEMBL4008950

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

Functional
Negative allosteric modulation of human mGluR5a expressed in CHO cells assessed as reduction in DHPG-induced cytosolic Ca2+ influx after 10 to 20 mins by fluo-4/AM-dye based fluorometric analysis
16
Total Activities
16
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Metabotropic glutamate receptor 5 (CHEMBL3227)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery and Preclinical Characterization of 3-((4-(4-Chlorophenyl)-7-fluoroquinoline-3-yl)sulfonyl)benzonitrile, a Novel Non-acetylenic Metabotropic Glutamate Receptor 5 (mGluR5) Negative Allosteric Modulator for Psychiatric Indications.
Galambos J, Bielik A, Krasavin M, Orgován Z, Domány G, Nógrádi K, Wágner G, Balogh GT, Béni Z, Kóti J, Szakács Z, Bobok A, Kolok S, Mikó-Bakk ML, Vastag M, Sághy K, Laszy J, Halász AS, Balázs O, Gál K, Greiner I, Szombathelyi Z, Keserű GM.
J Med Chem (2017) 60 : 2470 -2484
PubMed 28212015 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 16 7.49 7.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4068928 1 7.92
CHEMBL3763653 1 7.89
CHEMBL4097994 1 7.70
CHEMBL4081358 1 7.68
CHEMBL4082155 1 7.66
CHEMBL4070152 1 7.60
CHEMBL4098854 1 7.60
CHEMBL3764943 1 7.60
CHEMBL4096394 1 7.57
CHEMBL66654 1 7.51
CHEMBL4091111 1 7.46
CHEMBL4069140 1 7.37
CHEMBL4080811 1 7.16
CHEMBL4088680 1 7.13
CHEMBL4090008 1 7.03
CHEMBL3765114 1 6.88

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4068928 IC50 = 12.0 nM 7.92
CHEMBL3763653 IC50 = 13.0 nM 7.89
CHEMBL4097994 IC50 = 20.0 nM 7.70
CHEMBL4081358 IC50 = 21.0 nM 7.68
CHEMBL4082155 IC50 = 22.0 nM 7.66
CHEMBL4070152 IC50 = 25.0 nM 7.60
CHEMBL4098854 IC50 = 25.0 nM 7.60
CHEMBL3764943 IC50 = 25.0 nM 7.60
CHEMBL4096394 IC50 = 27.0 nM 7.57
CHEMBL66654 IC50 = 31.0 nM 7.51
CHEMBL4091111 IC50 = 35.0 nM 7.46
CHEMBL4069140 IC50 = 43.0 nM 7.37
CHEMBL4080811 IC50 = 69.0 nM 7.16
CHEMBL4088680 IC50 = 74.0 nM 7.13
CHEMBL4090008 IC50 = 94.0 nM 7.03
CHEMBL3765114 IC50 = 133.0 nM 6.88