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Assay Detail

CHEMBL677305

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

Binding
Binding affinity towards human Endothelin A receptor (hET -A)
31
Total Activities
27
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Endothelin-1 receptor (CHEMBL252)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Pyrrolidine-3-carboxylic acids as endothelin antagonists. 4. Side chain conformational restriction leads to ET(B) selectivity.
von Geldern TW, Tasker AS, Sorensen BK, Winn M, Szczepankiewicz BG, Dixon DB, Chiou WJ, Wang L, Wessale JL, Adler A, Marsh KC, Nguyen B, Opgenorth TJ.
J Med Chem (1999) 42 : 3668 -3678
PubMed 10479298 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 31 7.02 10.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL111277 1 10.10
CHEMBL9194 ATRASENTAN 3.0 1 10.10
CHEMBL420729 1 8.00
CHEMBL123305 1 7.92
CHEMBL421073 1 7.82
CHEMBL123997 1 7.82
CHEMBL122832 1 7.80
CHEMBL332231 1 7.80
CHEMBL2370534 1 7.75
CHEMBL333972 1 7.66
CHEMBL120106 1 7.60
CHEMBL122111 1 7.48
CHEMBL331767 1 7.48
CHEMBL339657 2 7.35
CHEMBL332431 1 7.30
CHEMBL123926 1 7.21
CHEMBL435185 1 7.00
CHEMBL123077 1 6.80
CHEMBL332093 1 6.72
CHEMBL332387 1 6.70
CHEMBL435385 2 6.47
CHEMBL331758 1 6.08
CHEMBL332627 1 6.04
CHEMBL333009 1 5.82
CHEMBL331625 2 5.43
CHEMBL332794 A-192621 2 5.09
CHEMBL331066 1 4.96

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL111277 IC50 = 0.08 nM 10.10
CHEMBL9194 ATRASENTAN IC50 = 0.08 nM 10.10
CHEMBL420729 IC50 = 10.0 nM 8.00
CHEMBL123305 IC50 = 12.0 nM 7.92
CHEMBL123997 IC50 = 15.0 nM 7.82
CHEMBL421073 IC50 = 15.0 nM 7.82
CHEMBL122832 IC50 = 16.0 nM 7.80
CHEMBL332231 IC50 = 16.0 nM 7.80
CHEMBL2370534 IC50 = 18.0 nM 7.75
CHEMBL333972 IC50 = 22.0 nM 7.66
CHEMBL120106 IC50 = 25.0 nM 7.60
CHEMBL331767 IC50 = 33.0 nM 7.48
CHEMBL122111 IC50 = 33.0 nM 7.48
CHEMBL339657 IC50 = 45.0 nM 7.35
CHEMBL332431 IC50 = 50.0 nM 7.30
CHEMBL123926 IC50 = 61.0 nM 7.21
CHEMBL339657 IC50 = 89.0 nM 7.05
CHEMBL435185 IC50 = 100.0 nM 7.00
CHEMBL123077 IC50 = 160.0 nM 6.80
CHEMBL332093 IC50 = 190.0 nM 6.72
CHEMBL332387 IC50 = 200.0 nM 6.70
CHEMBL435385 IC50 = 340.0 nM 6.47
CHEMBL331758 IC50 = 840.0 nM 6.08
CHEMBL332627 IC50 = 920.0 nM 6.04
CHEMBL435385 IC50 = 910.0 nM 6.04
CHEMBL333009 IC50 = 1500.0 nM 5.82
CHEMBL331625 IC50 = 3700.0 nM 5.43
CHEMBL331625 IC50 = 4200.0 nM 5.38
CHEMBL332794 A-192621 IC50 = 8200.0 nM 5.09
CHEMBL332794 A-192621 IC50 = 9900.0 nM 5.00
CHEMBL331066 IC50 = 11000.0 nM 4.96