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Assay Detail

CHEMBL1820132

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

Binding
Inhibition of recombinant human renin using of DABCYL-c-Abu-IleHis-Pro-Phe-His-Leu-Val-Ile-His-Thr-EDANS as substrate after 60 to 360 mins by fluorescence method
35
Total Activities
35
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

Renin (CHEMBL286)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Biphenyl/diphenyl ether renin inhibitors: filling the S1 pocket of renin via the S3 pocket.
Yuan J, Simpson RD, Zhao W, Tice CM, Xu Z, Cacatian S, Jia L, Flaherty PT, Guo J, Ishchenko A, Wu Z, McKeever BM, Scott BB, Bukhtiyarov Y, Berbaum J, Panemangalore R, Bentley R, Doe CP, Harrison RK, McGeehan GM, Singh SB, Dillard LW, Baldwin JJ, Claremon DA.
Bioorg Med Chem Lett (2011) 21 : 4836 -4843
PubMed 21741239 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 35 8.00 9.30

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL496430 1 9.30
CHEMBL1818070 1 9.15
CHEMBL1818069 1 8.96
CHEMBL1818063 1 8.96
CHEMBL1818049 1 8.92
CHEMBL1818055 1 8.85
CHEMBL1818064 1 8.80
CHEMBL1818062 1 8.80
CHEMBL1818058 1 8.80
CHEMBL1818067 1 8.74
CHEMBL1818059 1 8.72
CHEMBL1818065 1 8.68
CHEMBL1818054 1 8.68
CHEMBL1818071 1 8.64
CHEMBL1818068 1 8.60
CHEMBL1818047 1 8.57
CHEMBL1818060 1 8.43
CHEMBL1818066 1 8.42
CHEMBL1818061 1 8.28
CHEMBL1818056 1 8.15
CHEMBL1818039 1 8.06
CHEMBL1818052 1 8.00
CHEMBL1818048 1 7.96
CHEMBL1818046 1 7.72
CHEMBL1818053 1 7.70
CHEMBL1818051 1 7.64
CHEMBL1818050 1 7.43
CHEMBL1818041 1 6.90
CHEMBL1818043 1 6.71
CHEMBL1818040 1 6.38

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL496430 IC50 = 0.5 nM 9.30
CHEMBL1818070 IC50 = 0.7 nM 9.15
CHEMBL1818069 IC50 = 1.1 nM 8.96
CHEMBL1818063 IC50 = 1.1 nM 8.96
CHEMBL1818049 IC50 = 1.2 nM 8.92
CHEMBL1818055 IC50 = 1.4 nM 8.85
CHEMBL1818064 IC50 = 1.6 nM 8.80
CHEMBL1818062 IC50 = 1.6 nM 8.80
CHEMBL1818058 IC50 = 1.6 nM 8.80
CHEMBL1818067 IC50 = 1.8 nM 8.74
CHEMBL1818059 IC50 = 1.9 nM 8.72
CHEMBL1818065 IC50 = 2.1 nM 8.68
CHEMBL1818054 IC50 = 2.1 nM 8.68
CHEMBL1818071 IC50 = 2.3 nM 8.64
CHEMBL1818068 IC50 = 2.5 nM 8.60
CHEMBL1818047 IC50 = 2.7 nM 8.57
CHEMBL1818060 IC50 = 3.7 nM 8.43
CHEMBL1818066 IC50 = 3.8 nM 8.42
CHEMBL1818061 IC50 = 5.2 nM 8.28
CHEMBL1818056 IC50 = 7.1 nM 8.15
CHEMBL1818039 IC50 = 8.8 nM 8.06
CHEMBL1818052 IC50 = 10.0 nM 8.00
CHEMBL1818048 IC50 = 11.0 nM 7.96
CHEMBL1818046 IC50 = 19.0 nM 7.72
CHEMBL1818053 IC50 = 20.0 nM 7.70
CHEMBL1818051 IC50 = 23.0 nM 7.64
CHEMBL1818050 IC50 = 37.0 nM 7.43
CHEMBL1818041 IC50 = 126.0 nM 6.90
CHEMBL1818043 IC50 = 195.0 nM 6.71
CHEMBL1818040 IC50 = 420.0 nM 6.38
CHEMBL1818038 IC50 = 596.0 nM 6.22
CHEMBL1818044 IC50 = 1437.0 nM 5.84
CHEMBL1818042 IC50 = 2900.0 nM 5.54
CHEMBL1818057 IC50 = 4700.0 nM 5.33
CHEMBL1818045 IC50 > 5000.0 nM -