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Assay Detail

CHEMBL994712

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

Binding
Displacement of [125I]substance P human recombinant NK1 receptor expressed in CHO cells in presence of human serum albumin
8
Total Activities
8
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type CHO
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Substance-P receptor (CHEMBL249)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Potent, brain-penetrant, hydroisoindoline-based human neurokinin-1 receptor antagonists.
Jiang J, Bunda JL, Doss GA, Chicchi GG, Kurtz MM, Tsao KL, Tong X, Zheng S, Upthagrove A, Samuel K, Tschirret-Guth R, Kumar S, Wheeldon A, Carlson EJ, Hargreaves R, Burns D, Hamill T, Ryan C, Krause SM, Eng W, DeVita RJ, Mills SG.
J Med Chem (2009) 52 : 3039 -3046
PubMed 19354254 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 8 7.85 8.14

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL473680 1 8.14
CHEMBL484134 1 8.11
CHEMBL447955 SERLOPITANT 3.0 1 8.02
CHEMBL490869 1 8.01
CHEMBL445686 1 7.96
CHEMBL484133 1 7.77
CHEMBL499004 1 7.66
CHEMBL445239 1 7.14

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL473680 IC50 = 7.3 nM 8.14
CHEMBL484134 IC50 = 7.8 nM 8.11
CHEMBL447955 SERLOPITANT IC50 = 9.5 nM 8.02
CHEMBL490869 IC50 = 9.8 nM 8.01
CHEMBL445686 IC50 = 11.0 nM 7.96
CHEMBL484133 IC50 = 17.0 nM 7.77
CHEMBL499004 IC50 = 22.0 nM 7.66
CHEMBL445239 IC50 = 73.0 nM 7.14