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Assay Detail

CHEMBL648350

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Binding
Inhibition of guinea pig angiotensin I converting enzyme
30
Total Activities
30
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Angiotensin-converting enzyme (CHEMBL1808)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Synthesis of novel angiotensin converting enzyme inhibitor quinapril and related compounds. A divergence of structure-activity relationships for non-sulfhydryl and sulfhydryl types.
Klutchko S, Blankley CJ, Fleming RW, Hinkley JM, Werner AE, Nordin I, Holmes A, Hoefle ML, Cohen DM, Essenburg AD.
J Med Chem (1986) 29 : 1953 -1961
PubMed 3020249 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 30 6.42 8.62

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL577 ENALAPRILAT ANHYDROUS 4.0 1 8.62
CHEMBL1733 QUINAPRILAT 2.0 1 8.55
CHEMBL58042 1 8.52
CHEMBL58480 1 8.51
CHEMBL61811 1 8.24
CHEMBL1592 QUINAPRIL 4.0 1 8.08
CHEMBL1560 CAPTOPRIL 4.0 1 7.89
CHEMBL279737 1 7.75
CHEMBL2115478 1 7.36
CHEMBL1165 MOEXIPRIL 4.0 1 7.25
CHEMBL58720 1 6.89
CHEMBL578 ENALAPRIL 4.0 1 6.85
CHEMBL2114322 1 6.70
CHEMBL58340 1 6.52
CHEMBL412893 1 6.36
CHEMBL60702 1 6.28
CHEMBL2115075 1 5.96
CHEMBL2115288 1 5.21
CHEMBL62203 1 4.85
CHEMBL61137 1 4.66
CHEMBL57200 1 4.62
CHEMBL59354 1 4.32
CHEMBL57202 1 4.31
CHEMBL61916 1 4.24
CHEMBL417226 1 4.24
CHEMBL3350318 1 4.05
CHEMBL57201 1 -
CHEMBL2115076 1 -
CHEMBL291552 1 -
CHEMBL59401 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL577 ENALAPRILAT ANHYDROUS IC50 = 2.4 nM 8.62
CHEMBL1733 QUINAPRILAT IC50 = 2.8 nM 8.55
CHEMBL58042 IC50 = 3.0 nM 8.52
CHEMBL58480 IC50 = 3.1 nM 8.51
CHEMBL61811 IC50 = 5.8 nM 8.24
CHEMBL1592 QUINAPRIL IC50 = 8.3 nM 8.08
CHEMBL1560 CAPTOPRIL IC50 = 13.0 nM 7.89
CHEMBL279737 IC50 = 18.0 nM 7.75
CHEMBL2115478 IC50 = 44.0 nM 7.36
CHEMBL1165 MOEXIPRIL IC50 = 56.0 nM 7.25
CHEMBL58720 IC50 = 130.0 nM 6.89
CHEMBL578 ENALAPRIL IC50 = 140.0 nM 6.85
CHEMBL2114322 IC50 = 200.0 nM 6.70
CHEMBL58340 IC50 = 300.0 nM 6.52
CHEMBL412893 IC50 = 440.0 nM 6.36
CHEMBL60702 IC50 = 520.0 nM 6.28
CHEMBL2115075 IC50 = 1100.0 nM 5.96
CHEMBL2115288 IC50 = 6100.0 nM 5.21
CHEMBL62203 IC50 = 14000.0 nM 4.85
CHEMBL61137 IC50 = 22000.0 nM 4.66
CHEMBL57200 IC50 = 24000.0 nM 4.62
CHEMBL59354 IC50 = 48000.0 nM 4.32
CHEMBL57202 IC50 = 49000.0 nM 4.31
CHEMBL61916 IC50 = 58000.0 nM 4.24
CHEMBL417226 IC50 = 58000.0 nM 4.24
CHEMBL3350318 IC50 = 90000.0 nM 4.05
CHEMBL57201 IC50 > 100000.0 nM -
CHEMBL2115076 IC50 > 1000.0 nM -
CHEMBL291552 IC50 > 10000.0 nM -
CHEMBL59401 IC50 - nM -