====== Thapsigargin 0.005μM R07 exp407 ======
==== Mechanism of Action ====
Inhibits sarco/endoplasmic reticulum Ca2+ ATPase (SERCA), non-competitive inhibitor, raises intracellular calcium concentration
  * **<color #00a2e8>Class / Subclass 1:</color>** Organelle Function / Membrane Transport Inhibitor
  * **<color #00a2e8>Class / Subclass 2:</color>** Signal Transduction / Ion Channel Inhibitor



==== Technical Notes ====
<accordion collapsed='true'>
<panel title='Compound References' collapsed='true'>
    * **<color #00a2e8>PubChem Name:</color>** %%Thapsigargin%%
    * **<color #00a2e8>Synonyms:</color>** N/A
    * **<color #00a2e8>CAS #:</color>** 67526-95-8
    * **<color #00a2e8>PubChem CID:</color>** [[https://pubchem.ncbi.nlm.nih.gov/compound/446378|446378]]
    * **<color #00a2e8>IUPAC:</color>** %%[(3S,3aR,4S,6S,6aR,7S,8S,9bS)-6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-8-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-7-yl] octanoate%%
    * **<color #00a2e8>INCHI Name:</color>** InChI=1S/C34H50O12/c1-9-12-13-14-15-17-24(37)43-28-26-25(20(5)27(28)44-30(38)19(4)11-3)29-34(41,33(8,40)31(39)45-29)22(42-23(36)16-10-2)18-32(26,7)46-21(6)35/h11,22,26-29,40-41H,9-10,12-18H2,1-8H3/b19-11-/t22-,26+,27-,28-,29-,32-,33+,34+/m0/s1
    * **<color #00a2e8>INCHI Key:</color>** IXFPJGBNCFXKPI-FSIHEZPISA-N
    * **<color #00a2e8>Molecular Weight:</color>** 650.8
    * **<color #00a2e8>Canonical SMILES:</color>** CCCCCCCC(=O)OC1C2C(=C(C1OC(=O)C(=CC)C)C)C3C(C(CC2(C)OC(=O)C)OC(=O)CCC)(C(C(=O)O3)(C)O)O
    * **<color #00a2e8>Isomeric SMILES:</color>** CCCCCCCC(=O)O[C@H]1[C@H]2C(=C([C@@H]1OC(=O)/C(=C\\C)/C)C)[C@H]3[C@]([C@H](C[C@]2(C)OC(=O)C)OC(=O)CCC)([C@](C(=O)O3)(C)O)O
    * **<color #00a2e8>Molecular Formula:</color>** C34H50O12
{{:chemogenomics:structures:chem-0245.svg?nolink}}
</panel>


<panel title='Compound Supplier' collapsed='true'>
    * **<color #00a2e8>Supplier Name:</color>** Cayman Chemical
    * **<color #00a2e8>Catalog #:</color>** 10522
    * **<color #00a2e8>Lot #:</color>** 0507161-12
</panel>


<panel title='Compound Characterization' collapsed='true'>
    * **<color #00a2e8>HRMS (ESI-TOF) m/z:</color>** (M+Na)+ Calcd for C34H50O12 673.31945; found 673.32042
</panel>


<panel title='Dose Response Curve' collapsed='true'>
    * **<color #00a2e8>Platform ID:</color>** Thapsigargin
    * **<color #00a2e8>Min:</color>** 14.5736; **<color #00a2e8>Max:</color>** 99.8187
{{:chemogenomics:dose_response:dr_405.png?nolink&500 |}}
\\ 
\\ 
\\ 
\\ 
|< 300px 100px 200px >|
^ IC   ^ Concentration (µM) ^
| IC10  |N/A    |
| IC20  |N/A    |
| IC30  |0.0032    |
| IC40  |0.0061    |
| IC50  |0.0103    |
| IC60  |N/A    |
| IC70  |N/A    |
| IC80  |N/A    |
| IC90  |N/A    |
\\ 
</panel>
</accordion>
==== Screen Summary ====
    * **<color #00a2e8>Round</color>**: 07
    * **<color #00a2e8>Dose</color>**: 5nM
    * **<color #00a2e8>Days of incubation</color>**: 8
    * **<color #00a2e8>Doublings</color>**: 3.4
    * **<color #00a2e8>Numbers of reads</color>**: 22303546


==== 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^
|34/54|<color #e85500>[[https://files.tyerslab.com/files/public/chemogenomics/cranks/Thapsigargin_0.005uM_Round-7_exp407.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="primary" size="sm" modal="modal_go_sensitive">View</button>|<button type="default" size="sm" modal="modal_go_resistant">View</button>|
<modal id='ScorePlot' size='lg' title='Thapsigargin 0.005μM R07 exp407'>
{{:chemogenomics:cranks_plots:exp407.png?nolink}}
</modal>


<modal id="modal_hits" size="sm" title="Top 30 S/R Genes">
^Gene^CRANKS Score^FDR^
|[[:human_genes:A:ATP2A3|ATP2A3]]|-4.64|<0.01|
|[[:human_genes:D:DERL1|DERL1]]|-4.12|<0.01|
|[[:human_genes:S:STIM1|STIM1]]|-3.94|<0.01|
|[[:human_genes:D:DERL2|DERL2]]|-3.86|<0.01|
|[[:human_genes:B:BCL2|BCL2]]|-3.07|<0.01|
|[[:human_genes:D:DNAJC3|DNAJC3]]|-3.07|<0.01|
|[[:human_genes:A:AGPS|AGPS]]|-3.01|0.01|
|[[:human_genes:T:TCF4|TCF4]]|-2.98|<0.01|
|[[:human_genes:P:P4HB|P4HB]]|-2.87|<0.01|
|[[:human_genes:Q:QRICH1|QRICH1]]|-2.86|0.02|
|[[:human_genes:C:CPSF7|CPSF7]]|-2.82|<0.01|
|[[:human_genes:R:RNF170|RNF170]]|-2.81|<0.01|
|[[:human_genes:N:NRAS|NRAS]]|-2.77|0.02|
|[[:human_genes:E:ERLIN2|ERLIN2]]|-2.75|0.02|
|[[:human_genes:K:KIAA0922|KIAA0922]]|-2.67|0.01|
|[[:human_genes:T:TRAF2|TRAF2]]|-2.65|0.02|
|[[:human_genes:E:EEF2|EEF2]]|-2.63|0.35|
|[[:human_genes:S:SARS|SARS]]|-2.60|0.07|
|[[:human_genes:A:ARF1|ARF1]]|-2.59|0.02|
|[[:human_genes:A:ALG5|ALG5]]|-2.55|0.02|
|[[:human_genes:A:ALG9|ALG9]]|-2.50|0.02|
|[[:human_genes:E:ERLIN1|ERLIN1]]|-2.47|0.02|
|[[:human_genes:Z:ZMYM2|ZMYM2]]|-2.46|0.02|
|[[:human_genes:M:MTF2|MTF2]]|-2.46|0.04|
|[[:human_genes:F:FDPS|FDPS]]|-2.46|0.02|
|[[:human_genes:B:BIRC2|BIRC2]]|-2.44|0.07|
|[[:human_genes:R:RER1|RER1]]|-2.42|0.03|
|[[:human_genes:M:MXD3|MXD3]]|-2.39|0.05|
|[[:human_genes:G:GTF2I|GTF2I]]|-2.36|0.04|
|[[:human_genes:O:OSTC|OSTC]]|-2.36|0.05|
|[[:human_genes:M:MARCH5|MARCH5]]|2.62|<0.01|
|[[:human_genes:A:ARID4A|ARID4A]]|2.63|<0.01|
|[[:human_genes:B:BAK1|BAK1]]|2.66|<0.01|
|[[:human_genes:C:CMAS|CMAS]]|2.71|<0.01|
|[[:human_genes:G:GSS|GSS]]|2.71|<0.01|
|[[:human_genes:P:POU2F1|POU2F1]]|2.72|0.02|
|[[:human_genes:C:CREB1|CREB1]]|2.78|<0.01|
|[[:human_genes:D:DGKD|DGKD]]|2.79|<0.01|
|[[:human_genes:N:NF1|NF1]]|2.81|<0.01|
|[[:human_genes:C:CDK2|CDK2]]|2.84|<0.01|
|[[:human_genes:O:ORAI2|ORAI2]]|2.85|<0.01|
|[[:human_genes:I:IKZF1|IKZF1]]|2.87|<0.01|
|[[:human_genes:C:CHD7|CHD7]]|2.88|<0.01|
|[[:human_genes:D:DYNLL1|DYNLL1]]|2.90|<0.01|
|[[:human_genes:I:IKZF2|IKZF2]]|2.96|<0.01|
|[[:human_genes:G:GCLM|GCLM]]|3.20|0.00|
|[[:human_genes:R:RPRD1B|RPRD1B]]|3.33|0.00|
|[[:human_genes:P:PPP3R1|PPP3R1]]|3.41|0.00|
|[[:human_genes:N:N6AMT1|N6AMT1]]|3.44|0.00|
|[[:human_genes:N:NPTN|NPTN]]|3.44|0.00|
|[[:human_genes:S:SP2|SP2]]|3.60|0.00|
|[[:human_genes:S:SPI1|SPI1]]|3.63|0.00|
|[[:human_genes:N:NANS|NANS]]|3.76|0.00|
|[[:human_genes:S:STT3B|STT3B]]|3.80|0.00|
|[[:human_genes:E:EBF1|EBF1]]|3.82|0.00|
|[[:human_genes:E:ERP44|ERP44]]|3.84|0.00|
|[[:human_genes:S:SCAP|SCAP]]|3.90|0.00|
|[[:human_genes:M:MAGT1|MAGT1]]|4.29|0.00|
|[[:human_genes:N:NFATC3|NFATC3]]|4.34|0.00|
|[[:human_genes:A:ATP2B1|ATP2B1]]|8.44|0.00|
</modal>


<modal id="modal_screen_similarity" size="lg" title="Correlated Screens">
^Screen^Correlation^Plot^
|[[:results:exp416|Tubacin 1.6μM R07 exp416]]|0.057|<button type="primary" size="small" modal="1">View</button>|
|[[:results:exp420|Tunicamycin 0.04 to 0.125μM  on day4 R07 exp420]]|0.056|<button type="primary" size="small" modal="2">View</button>|
|[[:results:exp38|Wortmannin 5μM R00 exp38]]|0.056|<button type="primary" size="small" modal="3">View</button>|
|[[:results:exp492|iCRT14 30μM R08 exp492]]|0.053|<button type="primary" size="small" modal="4">View</button>|
|[[:results:exp497|Lead acetate 2000μM R08 exp497]]|0.094|<button type="primary" size="small" modal="5">View</button>|
|[[:results:exp234|Ethanol 0.01 R05 exp234]]|0.083|<button type="primary" size="small" modal="6">View</button>|
|[[:results:exp485|GSK626616 14μM R08 exp485]]|0.082|<button type="primary" size="small" modal="7">View</button>|
|[[:results:exp498|Lead acetate 2000μM R08 exp498 no dilution day6]]|0.075|<button type="primary" size="small" modal="8">View</button>|
|[[:results:exp334|All-trans-Retinoic-Acid 40μM R07 exp334]]|0.069|<button type="primary" size="small" modal="9">View</button>|
|[[:results:exp488|Hippuristanol 0.12μM R08 exp488]]|0.068|<button type="primary" size="small" modal="10">View</button>|
|[[:results:exp36|TRAIL 50ng/ml R00 exp36]]|0.065|<button type="primary" size="small" modal="11">View</button>|
|[[:results:exp352|Dexamethasone 0.006 to 0.015μM on day4 R07 exp352]]|0.063|<button type="primary" size="small" modal="12">View</button>|
|[[:results:exp455|Benzoate 10000μM R08 exp455]]|0.062|<button type="primary" size="small" modal="13">View</button>|
|[[:results:exp6|Bortezomib 0.005μM R00 exp6]]|0.061|<button type="primary" size="small" modal="14">View</button>|
|[[:results:exp489|Hippuristanol 0.12μM R08 exp489 no dilution day6]]|0.059|<button type="primary" size="small" modal="15">View</button>|
|[[:results:exp468|CB-5083 0.4μM R08 exp468]]|0.058|<button type="primary" size="small" modal="16">View</button>|
|[[:results:exp357|Dorsomorphin 5μM R07 exp357]]|0.055|<button type="primary" size="small" modal="17">View</button>|
|[[:results:exp214|2-Deoxy-D-glucose 800μM R05 exp214]]|0.055|<button type="primary" size="small" modal="18">View</button>|
|[[:results:exp342|Calcium Ionophore 0.4μM R07 exp342]]|0.055|<button type="primary" size="small" modal="19">View</button>|
|[[:results:exp335|Aminopterin 0.005μM R07 exp335]]|0.054|<button type="primary" size="small" modal="20">View</button>|
|[[:results:exp35|TRAIL 5ng/ml R00 exp35]]|0.054|<button type="primary" size="small" modal="21">View</button>|
|[[:results:exp30|Rapamycin 10μM R00 exp30]]|0.054|<button type="primary" size="small" modal="22">View</button>|
|[[:results:exp474|CR131-b 0.005μM R08 exp474]]|0.052|<button type="primary" size="small" modal="23">View</button>|
|[[:results:exp467|CAY10603 0.55μM R08 exp467]]|0.051|<button type="primary" size="small" modal="24">View</button>|
</modal>


<modal id="1" size="lg" title="Thapsigargin 0.005μM R07 exp407  vs  Tubacin 1.6μM R07 exp416">
{{:chemogenomics:comparison_plots:exp407_vs_exp416.png?nolink |}}
</modal>

<modal id="2" size="lg" title="Thapsigargin 0.005μM R07 exp407  vs  Tunicamycin 0.04 to 0.125μM  on day4 R07 exp420">
{{:chemogenomics:comparison_plots:exp407_vs_exp420.png?nolink |}}
</modal>

<modal id="3" size="lg" title="Thapsigargin 0.005μM R07 exp407  vs  Wortmannin 5μM R00 exp38">
{{:chemogenomics:comparison_plots:exp38_vs_exp407.png?nolink |}}
</modal>

<modal id="4" size="lg" title="Thapsigargin 0.005μM R07 exp407  vs  iCRT14 30μM R08 exp492">
{{:chemogenomics:comparison_plots:exp407_vs_exp492.png?nolink |}}
</modal>

<modal id="5" size="lg" title="Lead acetate 2000μM R08 exp497  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp407_vs_exp497.png?nolink |}}
</modal>

<modal id="6" size="lg" title="Ethanol 0.01 R05 exp234  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp234_vs_exp407.png?nolink |}}
</modal>

<modal id="7" size="lg" title="GSK626616 14μM R08 exp485  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp407_vs_exp485.png?nolink |}}
</modal>

<modal id="8" size="lg" title="Lead acetate 2000μM R08 exp498 no dilution day6  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp407_vs_exp498.png?nolink |}}
</modal>

<modal id="9" size="lg" title="All-trans-Retinoic-Acid 40μM R07 exp334  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp334_vs_exp407.png?nolink |}}
</modal>

<modal id="10" size="lg" title="Hippuristanol 0.12μM R08 exp488  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp407_vs_exp488.png?nolink |}}
</modal>

<modal id="11" size="lg" title="TRAIL 50ng/ml R00 exp36  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp36_vs_exp407.png?nolink |}}
</modal>

<modal id="12" size="lg" title="Dexamethasone 0.006 to 0.015μM on day4 R07 exp352  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp352_vs_exp407.png?nolink |}}
</modal>

<modal id="13" size="lg" title="Benzoate 10000μM R08 exp455  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp407_vs_exp455.png?nolink |}}
</modal>

<modal id="14" size="lg" title="Bortezomib 0.005μM R00 exp6  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp407_vs_exp6.png?nolink |}}
</modal>

<modal id="15" size="lg" title="Hippuristanol 0.12μM R08 exp489 no dilution day6  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp407_vs_exp489.png?nolink |}}
</modal>

<modal id="16" size="lg" title="CB-5083 0.4μM R08 exp468  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp407_vs_exp468.png?nolink |}}
</modal>

<modal id="17" size="lg" title="Dorsomorphin 5μM R07 exp357  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp357_vs_exp407.png?nolink |}}
</modal>

<modal id="18" size="lg" title="2-Deoxy-D-glucose 800μM R05 exp214  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp214_vs_exp407.png?nolink |}}
</modal>

<modal id="19" size="lg" title="Calcium Ionophore 0.4μM R07 exp342  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp342_vs_exp407.png?nolink |}}
</modal>

<modal id="20" size="lg" title="Aminopterin 0.005μM R07 exp335  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp335_vs_exp407.png?nolink |}}
</modal>

<modal id="21" size="lg" title="TRAIL 5ng/ml R00 exp35  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp35_vs_exp407.png?nolink |}}
</modal>

<modal id="22" size="lg" title="Rapamycin 10μM R00 exp30  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp30_vs_exp407.png?nolink |}}
</modal>

<modal id="23" size="lg" title="CR131-b 0.005μM R08 exp474  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp407_vs_exp474.png?nolink |}}
</modal>

<modal id="24" size="lg" title="CAY10603 0.55μM R08 exp467  vs  Thapsigargin 0.005μM R07 exp407">
{{:chemogenomics:comparison_plots:exp407_vs_exp467.png?nolink |}}
</modal>



<modal id="modal_go_sensitive" size="lg" title="Top 30 sensitive GO terms">
^GO Term^Fold Change^Genes^
|intrinsic apoptotic signaling pathway in response to endoplasmic reticulum stress|69.30|ATP2A3,BCL2,QRICH1,TRAF2|
|response to endoplasmic reticulum stress|25.52|ATP2A3,DERL1,DERL2,BCL2,DNAJC3,P4HB,QRICH1,ERLIN2,TRAF2,ERLIN1|
</modal>
<modal id="modal_go_resistant" size="lg" title="Top 30 resistant GO terms">No GO term hits below threshold. (FDR <0.05)</modal>