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Assay Detail

CHEMBL995612

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

Binding
Binding affinity to human GnRHR
27
Total Activities
25
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Gonadotropin-releasing hormone receptor (CHEMBL1855)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Potent and orally bioavailable zwitterion GnRH antagonists with low CYP3A4 inhibitory activity.
Chen C, Chen Y, Pontillo J, Guo Z, Huang CQ, Wu D, Madan A, Chen T, Wen J, Xie Q, Tucci FC, Rowbottom M, Zhu YF, Wade W, Saunders J, Bozigian H, Struthers RS.
Bioorg Med Chem Lett (2008) 18 : 3301 -3305
PubMed 18442910 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 27 7.85 9.19

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL434936 1 9.19
CHEMBL364914 1 9.05
CHEMBL189164 1 8.96
CHEMBL371613 1 8.89
CHEMBL509075 2 8.70
CHEMBL450471 2 8.50
CHEMBL508435 1 8.48
CHEMBL453167 1 8.47
CHEMBL508020 1 8.44
CHEMBL191817 1 8.28
CHEMBL192172 1 8.22
CHEMBL365985 1 8.11
CHEMBL499026 1 8.00
CHEMBL526327 1 7.66
CHEMBL455769 1 7.50
CHEMBL526887 1 7.38
CHEMBL445691 1 7.18
CHEMBL495882 1 7.16
CHEMBL499307 1 7.11
CHEMBL503624 1 6.96
CHEMBL497747 1 5.96
CHEMBL499589 1 5.43
CHEMBL499849 1 5.41
CHEMBL499588 1 -
CHEMBL456279 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL434936 Ki = 0.64 nM 9.19
CHEMBL364914 Ki = 0.9 nM 9.05
CHEMBL189164 Ki = 1.1 nM 8.96
CHEMBL371613 Ki = 1.3 nM 8.89
CHEMBL509075 Ki = 1.995 nM 8.70
CHEMBL509075 Ki = 2.2 nM 8.66
CHEMBL450471 Ki = 3.162 nM 8.50
CHEMBL508435 Ki = 3.3 nM 8.48
CHEMBL450471 Ki = 3.4 nM 8.47
CHEMBL453167 Ki = 3.4 nM 8.47
CHEMBL508020 Ki = 3.6 nM 8.44
CHEMBL191817 Ki = 5.3 nM 8.28
CHEMBL192172 Ki = 6.0 nM 8.22
CHEMBL365985 Ki = 7.8 nM 8.11
CHEMBL499026 Ki = 10.0 nM 8.00
CHEMBL526327 Ki = 22.0 nM 7.66
CHEMBL455769 Ki = 32.0 nM 7.50
CHEMBL526887 Ki = 42.0 nM 7.38
CHEMBL445691 Ki = 66.0 nM 7.18
CHEMBL495882 Ki = 69.0 nM 7.16
CHEMBL499307 Ki = 77.0 nM 7.11
CHEMBL503624 Ki = 110.0 nM 6.96
CHEMBL497747 Ki = 1100.0 nM 5.96
CHEMBL499589 Ki = 3700.0 nM 5.43
CHEMBL499849 Ki = 3900.0 nM 5.41
CHEMBL499588 Ki > 10000.0 nM -
CHEMBL456279 Ki > 10000.0 nM -