Brief Information of the Compound and Protein
Compound Name
(2S,4R)-4-Benzoylsulfanyl-2-(2,4,5-trifluoro-benzyloxymethyl)-pyrrolidine-1-carboxylic acid 2,3-dihydro-benzo[1,4]dioxin-5-yl ester
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PubChem ID
CID: 11192220
SID: 16273241
Canonical SMILES
Fc1cc(F)c(COC[C@@H]2C[C@H](CN2C(=O)Oc2cccc3OCCOc23)SC(=O)c2ccccc2)cc1F
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Compound Formula C28H24F3NO6S
Compound Structure
Protein Name
Endothelin-converting enzyme 1
Protein Classification
Enzyme
>
Protease
>
Metallo protease
>
Metallo protease MAE clan
>
Metallo protease M13 family
Uniprot ID
P42892
Gene Name
ECE1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000031 MDCK Canis lupus familiaris (Dog)  1
1
IC50 = 480.5 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 49.7 nM