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TB results #251

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KlementineJBS opened this issue Oct 31, 2024 · 4 comments
Open

TB results #251

KlementineJBS opened this issue Oct 31, 2024 · 4 comments

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@KlementineJBS
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KlementineJBS commented Oct 31, 2024

31/10/24

WPC and KBS compounds 30102024 with IC50.zip

@KlementineJBS
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KlementineJBS commented Oct 31, 2024

IC50 results

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Prism had warnings for these two below:
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@KlementineJBS
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@KlementineJBS
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Graphs

KBS52
KBS53

KBS19
KBS13
KBS44
KBS26

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Summary of results

Code Core Pendants IC50 in uM
KBS13 - 2021 cyclam 2 x adamantane 5.22
KBS13 - 2024 cyclam 2 x adamantane 5.74
KBS19 cyclam 2 x ferrocene 9.94
KBS26 1,6-diaminohexane 2 x adamantane 20.48*
KBS44 1,8-diaminooctane 2 x naphthalene 4.62
KBS53 1,6-diaminohexane 2 x naphthalene 5.79
KBS52 bis-(3-propylamine) 2 x naphthalene 11.75*

IC50s calculated by Prism. Value for KBS13 - 2021 was provided by Diane - presumably was calculated in the same way.

*Warning from Prism: "For at least one parameter, Prism was able to find a best-fit value, but was unable to calculate a complete confidence interval. This best-fit value should be interpreted with caution."

MICs from previous work:
In 2018 paper: lowest is 3.13 uM (naphthalimide), naphthalene pendant is comparable at 6.25 - 12.5 uM

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