====== ONC212 0.15μM R08 exp513 ======
==== Mechanism of Action ====
Inhibits mitochondrial CLPP protease, more potent derivative of TIC10/ONC201, possible agonist of GPR132
  * **<color #00a2e8>Class / Subclass 1:</color>** Proteostasis / Protease Inhibitor
  * **<color #00a2e8>Class / Subclass 2:</color>** Signal Transduction / GPCR Agonist



==== Technical Notes ====
<accordion collapsed='true'>
<panel title='Compound References' collapsed='true'>
    * **<color #00a2e8>PubChem Name:</color>** %%11-Benzyl-7-[[4-(trifluoromethyl)phenyl]methyl]-2,5,7,11-tetrazatricyclo[7.4.0.02,6]trideca-1(9),5-dien-8-one%%
    * **<color #00a2e8>Synonyms:</color>** N/A
    * **<color #00a2e8>CAS #:</color>** 1807861-48-8
    * **<color #00a2e8>PubChem CID:</color>** [[https://pubchem.ncbi.nlm.nih.gov/compound/124085867|124085867]]
    * **<color #00a2e8>IUPAC:</color>** %%11-benzyl-7-[[4-(trifluoromethyl)phenyl]methyl]-2,5,7,11-tetrazatricyclo[7.4.0.02,6]trideca-1(9),5-dien-8-one%%
    * **<color #00a2e8>INCHI Name:</color>** InChI=1S/C24H23F3N4O/c25-24(26,27)19-8-6-18(7-9-19)15-31-22(32)20-16-29(14-17-4-2-1-3-5-17)12-10-21(20)30-13-11-28-23(30)31/h1-9H,10-16H2
    * **<color #00a2e8>INCHI Key:</color>** DFULPGUTXZTYKA-UHFFFAOYSA-N
    * **<color #00a2e8>Molecular Weight:</color>** 440.5
    * **<color #00a2e8>Canonical SMILES:</color>** C1CN(CC2=C1N3CCN=C3N(C2=O)CC4=CC=C(C=C4)C(F)(F)F)CC5=CC=CC=C5
    * **<color #00a2e8>Isomeric SMILES:</color>** N/A
    * **<color #00a2e8>Molecular Formula:</color>** C24H23F3N4O
{{:chemogenomics:structures:chem-0318.svg?nolink}}
</panel>


<panel title='Compound Supplier' collapsed='true'>
    * **<color #00a2e8>Supplier Name:</color>** Med Chem Express
    * **<color #00a2e8>Catalog #:</color>** HY-111343
    * **<color #00a2e8>Lot #:</color>** 28375
</panel>


<panel title='Compound Characterization' collapsed='true'>
    * **<color #00a2e8>HRMS (ESI-TOF) m/z:</color>** (M+H)+ Calcd for C24H23F3N4O 441.18967; found 441.19306
</panel>


<panel title='Dose Response Curve' collapsed='true'>
    * **<color #00a2e8>Platform ID:</color>** ONC212
    * **<color #00a2e8>Min:</color>** 10.2172; **<color #00a2e8>Max:</color>** 89.4907
{{:chemogenomics:dose_response:dr_568.png?nolink&500 |}}
\\ 
\\ 
\\ 
\\ 
|< 300px 100px 200px >|
^ IC   ^ Concentration (µM) ^
| IC10  |0.0002    |
| IC20  |0.0022    |
| IC30  |0.0111    |
| IC40  |0.0426    |
| IC50  |0.1460    |
| IC60  |0.5004    |
| IC70  |1.9150    |
| IC80  |9.8420    |
| IC90  |115.5000    |
\\ 
</panel>
</accordion>
==== Screen Summary ====
    * **<color #00a2e8>Round</color>**: 08
    * **<color #00a2e8>Dose</color>**: 150nM
    * **<color #00a2e8>Days of incubation</color>**: 8
    * **<color #00a2e8>Doublings</color>**: 0.7
    * **<color #00a2e8>Numbers of reads</color>**: 17653962


==== Screen Results ====


^Sensitive/Resistant hits (FDR<0.05)^CRANKS^Score Plot^Top 30 Genes^Screen Similarity^Top 30 Sensitive GO terms^Top 30 Resistant GO terms^
|1/12|<color #e85500>[[https://files.tyerslab.com/files/public/chemogenomics/cranks/ONC212_0.15uM_Round-8_exp513.txt|Scores]]</color>|<button type="primary" size="sm" modal="ScorePlot">View</button>|<button type="primary" size="sm" modal="modal_hits">View</button>|<button type="primary" size="sm" modal="modal_screen_similarity">View</button>|<button type="default" size="sm" modal="modal_go_sensitive">View</button>|<button type="primary" size="sm" modal="modal_go_resistant">View</button>|
<modal id='ScorePlot' size='lg' title='ONC212 0.15μM R08 exp513'>
{{:chemogenomics:cranks_plots:exp513.png?nolink}}
</modal>


<modal id="modal_hits" size="sm" title="Top 30 S/R Genes">
^Gene^CRANKS Score^FDR^
|[[:human_genes:C:CDCA8|CDCA8]]|-3.05|0.20|
|[[:human_genes:E:EEFSEC|EEFSEC]]|-2.97|0.02|
|[[:human_genes:S:SEL1L|SEL1L]]|-2.80|0.07|
|[[:human_genes:D:DHX8|DHX8]]|-2.75|0.35|
|[[:human_genes:M:MDM2|MDM2]]|-2.64|0.18|
|[[:human_genes:R:RNF32|RNF32]]|-2.59|0.07|
|[[:human_genes:A:ACP1|ACP1]]|-2.55|0.07|
|[[:human_genes:O:OTUB1|OTUB1]]|-2.53|0.16|
|[[:human_genes:Z:ZNF783|ZNF783]]|-2.33|0.35|
|[[:human_genes:T:TINF2|TINF2]]|-2.32|0.35|
|[[:human_genes:C:CDKL3|CDKL3]]|-2.29|0.33|
|[[:human_genes:C:CHMP2A|CHMP2A]]|-2.27|0.48|
|[[:human_genes:G:GPX4|GPX4]]|-2.22|0.26|
|[[:human_genes:A:ARHGEF35|ARHGEF35]]|-2.20|0.43|
|[[:human_genes:N:NCAPH|NCAPH]]|-2.18|0.44|
|[[:human_genes:P:POLR2E|POLR2E]]|-2.15|0.57|
|[[:human_genes:S:SURF6|SURF6]]|-2.11|0.57|
|[[:human_genes:P:PDE3B|PDE3B]]|-2.09|0.35|
|[[:human_genes:P:PBRM1|PBRM1]]|-2.08|0.35|
|[[:human_genes:P:POLE|POLE]]|-2.08|0.63|
|[[:human_genes:C:CROCC|CROCC]]|-2.07|0.50|
|[[:human_genes:N:NRCAM|NRCAM]]|-2.07|0.35|
|[[:human_genes:U:UBE2N|UBE2N]]|-2.06|0.35|
|[[:human_genes:E:ESPL1|ESPL1]]|-2.04|0.60|
|[[:human_genes:E:EBNA1BP2|EBNA1BP2]]|-2.04|0.44|
|[[:human_genes:K:KPTN|KPTN]]|-2.02|0.36|
|[[:human_genes:Z:ZNF433|ZNF433]]|-2.02|0.36|
|[[:human_genes:B:BHMT2|BHMT2]]|-2.01|0.36|
|[[:human_genes:I:IRF5|IRF5]]|-2.00|0.36|
|[[:human_genes:P:POLD2|POLD2]]|-2.00|0.63|
|[[:human_genes:M:MRPS28|MRPS28]]|2.29|0.05|
|[[:human_genes:A:ANGEL2|ANGEL2]]|2.30|0.05|
|[[:human_genes:R:RARS2|RARS2]]|2.31|0.05|
|[[:human_genes:M:MAPKAP1|MAPKAP1]]|2.31|0.06|
|[[:human_genes:U:UQCR10|UQCR10]]|2.32|0.05|
|[[:human_genes:M:MRPS34|MRPS34]]|2.33|0.05|
|[[:human_genes:G:GEMIN7|GEMIN7]]|2.33|0.05|
|[[:human_genes:M:MBTPS2|MBTPS2]]|2.37|0.05|
|[[:human_genes:A:ALDH18A1|ALDH18A1]]|2.37|0.05|
|[[:human_genes:H:HSD17B10|HSD17B10]]|2.37|0.05|
|[[:human_genes:A:ATF7IP|ATF7IP]]|2.38|0.05|
|[[:human_genes:R:RIF1|RIF1]]|2.39|0.05|
|[[:human_genes:S:SLC39A10|SLC39A10]]|2.39|0.05|
|[[:human_genes:M:MRPS5|MRPS5]]|2.40|0.05|
|[[:human_genes:A:ACSL4|ACSL4]]|2.40|0.05|
|[[:human_genes:H:HEMGN|HEMGN]]|2.44|0.04|
|[[:human_genes:M:MRPL21|MRPL21]]|2.44|0.04|
|[[:human_genes:F:FASTKD5|FASTKD5]]|2.49|0.05|
|[[:human_genes:K:KIAA0391|KIAA0391]]|2.50|0.05|
|[[:human_genes:C:CEPT1|CEPT1]]|2.51|0.04|
|[[:human_genes:K:KIF2A|KIF2A]]|2.60|0.04|
|[[:human_genes:T:TP53|TP53]]|2.60|0.04|
|[[:human_genes:F:FASTKD1|FASTKD1]]|2.61|0.04|
|[[:human_genes:M:MRPS6|MRPS6]]|2.72|0.04|
|[[:human_genes:S:STT3A|STT3A]]|2.80|0.05|
|[[:human_genes:M:MRPS33|MRPS33]]|2.86|0.04|
|[[:human_genes:U:UHRF1|UHRF1]]|2.87|0.04|
|[[:human_genes:E:EARS2|EARS2]]|3.34|<0.01|
|[[:human_genes:M:MIPEP|MIPEP]]|5.28|<0.01|
|[[:human_genes:C:CLPP|CLPP]]|6.19|<0.01|
</modal>


<modal id="modal_screen_similarity" size="lg" title="Correlated Screens">
^Screen^Correlation^Plot^
|[[:results:exp532|TIC10 10μM R08 exp532]]|0.145|<button type="primary" size="small" modal="1">View</button>|
|[[:results:exp527|Tanespimycin 14μM R08 exp527]]|0.095|<button type="primary" size="small" modal="2">View</button>|
|[[:results:exp529|Thimerosal 0.85μM R08 exp529]]|0.094|<button type="primary" size="small" modal="3">View</button>|
|[[:results:exp515|PU-H71 1μM R08 exp515]]|0.061|<button type="primary" size="small" modal="4">View</button>|
|[[:results:exp492|iCRT14 30μM R08 exp492]]|0.06|<button type="primary" size="small" modal="5">View</button>|
|[[:results:exp536|Vitamin-D3 40μM R08 exp536]]|0.051|<button type="primary" size="small" modal="6">View</button>|
|[[:results:exp441|GSK-J4 1.5μM R08 exp441]]|0.111|<button type="primary" size="small" modal="7">View</button>|
|[[:results:exp451|Atovaquone 15μM R08 exp451]]|0.076|<button type="primary" size="small" modal="8">View</button>|
|[[:results:exp329|Hydroxyurea 100μM R07 exp329]]|0.076|<button type="primary" size="small" modal="9">View</button>|
|[[:results:exp447|Amiloride 100μM R08 exp447]]|0.073|<button type="primary" size="small" modal="10">View</button>|
|[[:results:exp448|Ammonium tetrathiomolybdate 10μM R08 exp448]]|0.066|<button type="primary" size="small" modal="11">View</button>|
|[[:results:exp503|Mitomycin-C 0.06μM R08 exp503]]|0.063|<button type="primary" size="small" modal="12">View</button>|
|[[:results:exp440|Aphidicolin 0.4μM R08 exp440]]|0.06|<button type="primary" size="small" modal="13">View</button>|
|[[:results:exp474|CR131-b 0.005μM R08 exp474]]|0.06|<button type="primary" size="small" modal="14">View</button>|
|[[:results:exp487|Hinokiflavone 12μM R08 exp487]]|0.056|<button type="primary" size="small" modal="15">View</button>|
|[[:results:exp450|Artemisinin 50μM R08 exp450]]|0.055|<button type="primary" size="small" modal="16">View</button>|
|[[:results:exp472|CI-1040 9.5μM R08 exp472]]|0.051|<button type="primary" size="small" modal="17">View</button>|
</modal>


<modal id="1" size="lg" title="ONC212 0.15μM R08 exp513  vs  TIC10 10μM R08 exp532">
{{:chemogenomics:comparison_plots:exp513_vs_exp532.png?nolink |}}
</modal>

<modal id="2" size="lg" title="ONC212 0.15μM R08 exp513  vs  Tanespimycin 14μM R08 exp527">
{{:chemogenomics:comparison_plots:exp513_vs_exp527.png?nolink |}}
</modal>

<modal id="3" size="lg" title="ONC212 0.15μM R08 exp513  vs  Thimerosal 0.85μM R08 exp529">
{{:chemogenomics:comparison_plots:exp513_vs_exp529.png?nolink |}}
</modal>

<modal id="4" size="lg" title="ONC212 0.15μM R08 exp513  vs  PU-H71 1μM R08 exp515">
{{:chemogenomics:comparison_plots:exp513_vs_exp515.png?nolink |}}
</modal>

<modal id="5" size="lg" title="ONC212 0.15μM R08 exp513  vs  iCRT14 30μM R08 exp492">
{{:chemogenomics:comparison_plots:exp492_vs_exp513.png?nolink |}}
</modal>

<modal id="6" size="lg" title="ONC212 0.15μM R08 exp513  vs  Vitamin-D3 40μM R08 exp536">
{{:chemogenomics:comparison_plots:exp513_vs_exp536.png?nolink |}}
</modal>

<modal id="7" size="lg" title="GSK-J4 1.5μM R08 exp441  vs  ONC212 0.15μM R08 exp513">
{{:chemogenomics:comparison_plots:exp441_vs_exp513.png?nolink |}}
</modal>

<modal id="8" size="lg" title="Atovaquone 15μM R08 exp451  vs  ONC212 0.15μM R08 exp513">
{{:chemogenomics:comparison_plots:exp451_vs_exp513.png?nolink |}}
</modal>

<modal id="9" size="lg" title="Hydroxyurea 100μM R07 exp329  vs  ONC212 0.15μM R08 exp513">
{{:chemogenomics:comparison_plots:exp329_vs_exp513.png?nolink |}}
</modal>

<modal id="10" size="lg" title="Amiloride 100μM R08 exp447  vs  ONC212 0.15μM R08 exp513">
{{:chemogenomics:comparison_plots:exp447_vs_exp513.png?nolink |}}
</modal>

<modal id="11" size="lg" title="Ammonium tetrathiomolybdate 10μM R08 exp448  vs  ONC212 0.15μM R08 exp513">
{{:chemogenomics:comparison_plots:exp448_vs_exp513.png?nolink |}}
</modal>

<modal id="12" size="lg" title="Mitomycin-C 0.06μM R08 exp503  vs  ONC212 0.15μM R08 exp513">
{{:chemogenomics:comparison_plots:exp503_vs_exp513.png?nolink |}}
</modal>

<modal id="13" size="lg" title="Aphidicolin 0.4μM R08 exp440  vs  ONC212 0.15μM R08 exp513">
{{:chemogenomics:comparison_plots:exp440_vs_exp513.png?nolink |}}
</modal>

<modal id="14" size="lg" title="CR131-b 0.005μM R08 exp474  vs  ONC212 0.15μM R08 exp513">
{{:chemogenomics:comparison_plots:exp474_vs_exp513.png?nolink |}}
</modal>

<modal id="15" size="lg" title="Hinokiflavone 12μM R08 exp487  vs  ONC212 0.15μM R08 exp513">
{{:chemogenomics:comparison_plots:exp487_vs_exp513.png?nolink |}}
</modal>

<modal id="16" size="lg" title="Artemisinin 50μM R08 exp450  vs  ONC212 0.15μM R08 exp513">
{{:chemogenomics:comparison_plots:exp450_vs_exp513.png?nolink |}}
</modal>

<modal id="17" size="lg" title="CI-1040 9.5μM R08 exp472  vs  ONC212 0.15μM R08 exp513">
{{:chemogenomics:comparison_plots:exp472_vs_exp513.png?nolink |}}
</modal>



<modal id="modal_go_sensitive" size="lg" title="Top 30 sensitive GO terms">No GO term hits below threshold. (FDR <0.05)</modal>
<modal id="modal_go_resistant" size="lg" title="Top 30 resistant GO terms">
^GO Term^Fold Change^Genes^
|mitochondrial RNA processing|110.46|FASTKD1,PRORP,FASTKD5,HSD17B10|
|organellar small ribosomal subunit|89.08|MRPS33,MRPS6,MRPS5,MRPS34,MRPS28|
|mitochondrial small ribosomal subunit|71.26|MRPS6,MRPS5,MRPS34,MRPS28|
|mitochondrial RNA metabolic process|51.38|EARS2,FASTKD1,FASTKD5,HSD17B10|
|mitochondrial gene expression|47.68|EARS2,MRPS33,MRPS6,FASTKD1,PRORP,FASTKD5,MRPL21,MRPS5,HSD17B10,MRPS34,RARS2,MRPS28|
|mitochondrial translation|41.29|EARS2,MRPS33,MRPS6,MRPL21,MRPS5,MRPS34,RARS2,MRPS28|
|organellar ribosome|37.66|MRPS33,MRPS6,MRPL21,MRPS5,MRPS34,MRPS28|
|mitochondrial ribosome|37.66|MRPS33,MRPS6,MRPL21,MRPS5,MRPS34,MRPS28|
|ribosomal subunit|19.15|MRPS33,MRPS6,MRPL21,MRPS5,MRPS34,MRPS28|
|mitochondrial protein-containing complex|18.14|MRPS33,MRPS6,PRORP,MRPL21,MRPS5,HSD17B10,MRPS34,UQCR10,MRPS28|
|mitochondrial matrix|17.48|CLPP,MIPEP,EARS2,MRPS33,MRPS6,FASTKD1,TP53,PRORP,FASTKD5,MRPL21,MRPS5,HSD17B10,MRPS34,RARS2,MRPS28|
|ribosome|15.27|MRPS33,MRPS6,MRPL21,MRPS5,MRPS34,MRPS28|
|translation|12.38|EARS2,MRPS33,MRPS6,MRPL21,MRPS5,MRPS34,RARS2,MRPS28|
|peptide biosynthetic process|11.57|EARS2,MRPS33,MRPS6,MRPL21,MRPS5,MRPS34,RARS2,MRPS28|
|peptide metabolic process|10.49|MIPEP,EARS2,MRPS33,MRPS6,MRPL21,MRPS5,MRPS34,RARS2,MRPS28|
|amide biosynthetic process|9.88|EARS2,MRPS33,MRPS6,MRPL21,ACSL4,MRPS5,MRPS34,RARS2,MRPS28|
|mitochondrial inner membrane|9.65|MRPS33,MRPS6,MRPL21,MRPS5,ALDH18A1,MRPS34,UQCR10,MRPS28|
|organelle inner membrane|8.66|MRPS33,MRPS6,MRPL21,MRPS5,ALDH18A1,MRPS34,UQCR10,MRPS28|
|amide metabolic process|8.03|MIPEP,EARS2,MRPS33,MRPS6,MRPL21,ACSL4,MRPS5,ALDH18A1,MRPS34,RARS2,MRPS28|
</modal>