S. Ahmed et al., Hydrophobicity, a physicochemical factor in the inhibition of the enzyme estrone sulfatase (ES), BIOORG MED, 11(18), 2001, pp. 2525-2528
We report the initial structure-activity relationship study (SAR) (in parti
cular log P) of a series of compounds based upon 4-sulfamated phenyl ketone
s as potent inhibitors of the enzyme estrone sulfatase (ES). The results of
the study show that these compounds are irreversible inhibitors of ES and
that they are more potent than COUMATE, but weaker than ENTATE. Analysis of
the SAR data shows a strong correlation between IC50 and log P but also su
pports our previous study, which suggests a very strong relationship betwee
n pK(a) and IC50. (C) 2001 Elsevier Science Ltd. All rights reserved.