Table 3Hit summary, promiscuity analysis (reflects PubChem data available at time of uHTS)

StructurePubchem CIDPubchem SIDIDE EC50 HTS (μM)max responseActivity promiscuity analysis: active/total
Image ml345fu14.jpg
2325815248402271.410856/487
11.5%
Image ml345fu15.jpg
4089709497247922.111331/208
14.9%
Image ml345fu16.jpg
25181200251812002.41069/103
8.7%
Image ml345fu17.jpg
2327953248404134.010069/521
13.2%
hits of highest initial interest
Image ml345fu18.jpg
Image ml345fu19.jpg
6671888659302.61068/488
1.6%
Image ml345fu20.jpg
6649418636885.79813/496
2.6%
Image ml345fu21.jpg
1483690248180775.3763/328
0.9%
Image ml345fu22.jpg
17583130498251761.2852/268
0.7%
Image ml345fu23.jpg
4869155498224624.31075/211
2.4%
Image ml345fu24.jpg
2574532852713965.81275/95
5.3%

From: ML345, A Small-Molecule Inhibitor of the Insulin-Degrading Enzyme (IDE)

Cover of Probe Reports from the NIH Molecular Libraries Program
Probe Reports from the NIH Molecular Libraries Program [Internet].

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