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Assay Detail

CHEMBL745024

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

Binding
Binding affinity for NK2 receptor in HSKR-1 cells was determined by using [125 I ]-Iodohistidyl NKA.
21
Total Activities
21
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Cell Type HSKR-1
Confidence 8 — Homologous single protein target
Curated By Expert

Target

Substance-K receptor (CHEMBL2813)
Type SINGLE PROTEIN
Organism Mus musculus

Publication

Synthesis and structure-activity relationships for a series of substituted pyrrolidine NK1/NK2 receptor antagonists
Burkholder TP, Kudlacz EM, Maynard GD, Liu X, Le T, Webster ME, Horgan SW, Wenstrup DL, Freund DW, Boyer F, Bratton L, Gross RS, Knippenberg RW, Logan DE, Jones BK, Chen T, Geary JL, Correll MA, Chuck Poole J, Mandagere AK, Thompson TN, Hwang K
Bioorg Med Chem Lett (1997) 7 : 2531 -2536
· DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 21 7.75 8.69

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL540553 1 8.69
CHEMBL553617 1 8.66
CHEMBL315814 1 8.50
CHEMBL313931 1 8.44
CHEMBL553451 1 8.35
CHEMBL554092 1 8.11
CHEMBL539021 1 8.08
CHEMBL84055 1 8.03
CHEMBL553554 1 7.99
CHEMBL432183 1 7.93
CHEMBL313546 1 7.92
CHEMBL314119 1 7.79
CHEMBL315923 1 7.79
CHEMBL315982 1 7.77
CHEMBL82386 1 7.68
CHEMBL312173 1 7.24
CHEMBL310173 1 7.13
CHEMBL83585 1 6.72
CHEMBL315322 1 6.63
CHEMBL85499 1 5.56
CHEMBL83885 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL540553 IC50 = 2.05 nM 8.69
CHEMBL553617 IC50 = 2.19 nM 8.66
CHEMBL315814 IC50 = 3.13 nM 8.50
CHEMBL313931 IC50 = 3.64 nM 8.44
CHEMBL553451 IC50 = 4.51 nM 8.35
CHEMBL554092 IC50 = 7.77 nM 8.11
CHEMBL539021 IC50 = 8.4 nM 8.08
CHEMBL84055 IC50 = 9.39 nM 8.03
CHEMBL553554 IC50 = 10.2 nM 7.99
CHEMBL432183 IC50 = 11.8 nM 7.93
CHEMBL313546 IC50 = 12.0 nM 7.92
CHEMBL314119 IC50 = 16.2 nM 7.79
CHEMBL315923 IC50 = 16.4 nM 7.79
CHEMBL315982 IC50 = 17.1 nM 7.77
CHEMBL82386 IC50 = 21.0 nM 7.68
CHEMBL312173 IC50 = 57.9 nM 7.24
CHEMBL310173 IC50 = 74.5 nM 7.13
CHEMBL83585 IC50 = 190.0 nM 6.72
CHEMBL315322 IC50 = 235.0 nM 6.63
CHEMBL85499 IC50 = 2770.0 nM 5.56
CHEMBL83885 IC50 > 10000.0 nM -