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Assay Detail

CHEMBL807968

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

Binding
Displacement of [125I]-labeled SP from human Tachykinin receptor 1 expressed in CHO cells
15
Total Activities
12
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 Expert

Target

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

Publication

2(S)-((3,5-bis(trifluoromethyl)benzyl)-oxy)-3(S)-phenyl-4- ((3-oxo-1,2,4-triazol-5-yl)methyl)morpholine (1): a potent, orally active, morpholine-based human neurokinin-1 receptor antagonist.
Hale JJ, Mills SG, MacCoss M, Shah SK, Qi H, Mathre DJ, Cascieri MA, Sadowski S, Strader CD, MacIntyre DE, Metzger JM.
J Med Chem (1996) 39 : 1760 -1762
PubMed 8627597 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 15 8.25 10.05

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL52330 1 10.05
CHEMBL406136 1 9.89
CHEMBL16192 CP-96345 1 9.40
CHEMBL441225 CP-99994 1 9.30
CHEMBL27006 1 9.06
CHEMBL48680 1 8.96
CHEMBL300856 1 8.80
CHEMBL51648 1 8.62
CHEMBL300722 2 7.72
CHEMBL300303 2 7.68
CHEMBL294960 2 7.23
CHEMBL51477 1 7.18

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL52330 IC50 = 0.09 nM 10.05
CHEMBL406136 IC50 = 0.13 nM 9.89
CHEMBL16192 CP-96345 IC50 = 0.4 nM 9.40
CHEMBL441225 CP-99994 IC50 = 0.5 nM 9.30
CHEMBL27006 IC50 = 0.87 nM 9.06
CHEMBL48680 IC50 = 1.1 nM 8.96
CHEMBL300856 IC50 = 1.6 nM 8.80
CHEMBL51648 IC50 = 2.4 nM 8.62
CHEMBL300722 IC50 = 19.0 nM 7.72
CHEMBL300303 IC50 = 21.0 nM 7.68
CHEMBL294960 IC50 = 59.0 nM 7.23
CHEMBL51477 IC50 = 66.0 nM 7.18
CHEMBL294960 IC50 = 116.0 nM 6.94
CHEMBL300303 IC50 = 287.0 nM 6.54
CHEMBL300722 IC50 = 376.0 nM 6.42