====== iCRT14 30μM R08 exp492 ====== ==== Mechanism of Action ==== Inhibits β-catenin-dependent transcription, may alter interaction of β-catenin with TCF4 * **Class / Subclass 1:** Gene Regulation / Transcription Inhibitor ==== Technical Notes ==== * **PubChem Name:** %%CID 5967294%% * **Synonyms:** N/A * **CAS #:** 677331-12-3 * **PubChem CID:** [[https://pubchem.ncbi.nlm.nih.gov/compound/5967294|5967294]] * **IUPAC:** %%(5Z)-5-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-3-phenyl-1,3-thiazolidine-2,4-dione%% * **INCHI Name:** InChI=1S/C21H17N3O2S/c1-14-11-16(15(2)23(14)18-9-6-10-22-13-18)12-19-20(25)24(21(26)27-19)17-7-4-3-5-8-17/h3-13H,1-2H3/b19-12- * **INCHI Key:** NCSHZXNGQYSKLR-UNOMPAQXSA-N * **Molecular Weight:** 375.4 * **Canonical SMILES:** CC1=CC(=C(N1C2=CN=CC=C2)C)C=C3C(=O)N(C(=O)S3)C4=CC=CC=C4 * **Isomeric SMILES:** CC1=CC(=C(N1C2=CN=CC=C2)C)/C=C\\3/C(=O)N(C(=O)S3)C4=CC=CC=C4 * **Molecular Formula:** C21H17N3O2S {{:chemogenomics:structures:chem-0300.svg?nolink}} * **Supplier Name:** Med Chem Express * **Catalog #:** HY-16665 * **Lot #:** 23429 * **HRMS (ESI-TOF) m/z:** (M+H)+ Calcd for C21H17N3O2S 376.11142; found 376.11235 * **Platform ID:** iCRT14 * **Min:** -11.0010; **Max:** 69.6272 {{:chemogenomics:dose_response:dr_547.png?nolink&500 |}} \\ \\ \\ \\ |< 300px 100px 200px >| ^ IC ^ Concentration (µM) ^ | IC10 |4.0980 | | IC20 |8.5500 | | IC30 |13.9400 | | IC40 |20.8100 | | IC50 |30.0600 | | IC60 |43.4100 | | IC70 |64.8100 | | IC80 |N/A | | IC90 |N/A | \\ ==== Screen Summary ==== * **Round**: 08 * **Dose**: 30µM * **Days of incubation**: 8 * **Doublings**: 1.2 * **Numbers of reads**: 17101968 ==== 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^ |12/56|[[https://files.tyerslab.com/files/public/chemogenomics/cranks/iCRT14_30uM_Round-8_exp492.txt|Scores]]|||||| {{:chemogenomics:cranks_plots:exp492.png?nolink}} ^Gene^CRANKS Score^FDR^ |[[:human_genes:G:GOT1|GOT1]]|-3.77|<0.01| |[[:human_genes:P:PRKAG1|PRKAG1]]|-3.72|<0.01| |[[:human_genes:D:DERL2|DERL2]]|-3.50|<0.01| |[[:human_genes:F:FAM3A|FAM3A]]|-3.30|<0.01| |[[:human_genes:R:RPS17L|RPS17L]]|-3.28|0.04| |[[:human_genes:S:SNX27|SNX27]]|-3.10|<0.01| |[[:human_genes:S:SLC5A3|SLC5A3]]|-2.98|<0.01| |[[:human_genes:M:MGA|MGA]]|-2.82|<0.01| |[[:human_genes:U:URB1|URB1]]|-2.81|0.08| |[[:human_genes:C:CDK2|CDK2]]|-2.78|<0.01| |[[:human_genes:T:TCF4|TCF4]]|-2.77|<0.01| |[[:human_genes:C:CMC2|CMC2]]|-2.66|0.16| |[[:human_genes:P:PLK1|PLK1]]|-2.60|0.31| |[[:human_genes:P:PLD3|PLD3]]|-2.59|0.02| |[[:human_genes:Z:ZBTB1|ZBTB1]]|-2.56|0.05| |[[:human_genes:U:UXS1|UXS1]]|-2.54|0.03| |[[:human_genes:M:MNT|MNT]]|-2.51|0.06| |[[:human_genes:C:CDC20|CDC20]]|-2.45|0.16| |[[:human_genes:P:POLA1|POLA1]]|-2.38|0.30| |[[:human_genes:O:OGT|OGT]]|-2.36|0.31| |[[:human_genes:Z:ZFAND2B|ZFAND2B]]|-2.32|0.12| |[[:human_genes:T:THOC2|THOC2]]|-2.32|0.15| |[[:human_genes:S:SLC16A10|SLC16A10]]|-2.27|0.08| |[[:human_genes:D:DOT1L|DOT1L]]|-2.27|0.08| |[[:human_genes:R:RAB7A|RAB7A]]|-2.27|0.08| |[[:human_genes:H:HMGCS1|HMGCS1]]|-2.24|0.15| |[[:human_genes:Y:YPEL5|YPEL5]]|-2.21|0.11| |[[:human_genes:K:KEAP1|KEAP1]]|-2.20|0.15| |[[:human_genes:A:ATP6V0A2|ATP6V0A2]]|-2.19|0.15| |[[:human_genes:O:OR13G1|OR13G1]]|-2.19|0.12| |[[:human_genes:Z:ZBTB18|ZBTB18]]|2.55|0.01| |[[:human_genes:A:ALG13|ALG13]]|2.57|0.02| |[[:human_genes:P:PMAIP1|PMAIP1]]|2.59|<0.01| |[[:human_genes:Z:ZCRB1|ZCRB1]]|2.61|0.02| |[[:human_genes:P:P4HB|P4HB]]|2.63|<0.01| |[[:human_genes:H:HSD17B10|HSD17B10]]|2.70|0.01| |[[:human_genes:S:SEC62|SEC62]]|2.76|<0.01| |[[:human_genes:A:ALAS1|ALAS1]]|2.76|0.03| |[[:human_genes:P:PET117|PET117]]|2.77|<0.01| |[[:human_genes:P:PGM3|PGM3]]|2.77|<0.01| |[[:human_genes:S:SLC25A51|SLC25A51]]|2.79|<0.01| |[[:human_genes:R:RALGAPB|RALGAPB]]|2.82|<0.01| |[[:human_genes:D:DPH1|DPH1]]|2.84|<0.01| |[[:human_genes:A:ARRDC4|ARRDC4]]|2.86|<0.01| |[[:human_genes:K:KCTD5|KCTD5]]|2.86|<0.01| |[[:human_genes:K:KIAA0922|KIAA0922]]|2.89|<0.01| |[[:human_genes:W:WBSCR16|WBSCR16]]|2.93|0.08| |[[:human_genes:O:OMA1|OMA1]]|2.95|<0.01| |[[:human_genes:M:MLEC|MLEC]]|2.97|<0.01| |[[:human_genes:N:NDUFA2|NDUFA2]]|2.97|<0.01| |[[:human_genes:B:BAK1|BAK1]]|2.99|<0.01| |[[:human_genes:N:NANS|NANS]]|3.04|<0.01| |[[:human_genes:S:SYNCRIP|SYNCRIP]]|3.36|<0.01| |[[:human_genes:S:STARD7|STARD7]]|3.38|<0.01| |[[:human_genes:S:SPI1|SPI1]]|3.63|<0.01| |[[:human_genes:M:MLX|MLX]]|3.65|<0.01| |[[:human_genes:T:TMEM39A|TMEM39A]]|3.68|<0.01| |[[:human_genes:C:CXorf56|CXorf56]]|3.72|<0.01| |[[:human_genes:D:DDX3X|DDX3X]]|3.97|<0.01| |[[:human_genes:P:PPP6C|PPP6C]]|3.97|<0.01| ^Screen^Correlation^Plot^ |[[:results:exp25|Oligomycin-A 2μM R00 exp25]]|0.095|| |[[:results:exp400|Senexin-A 25μM R07 exp400]]|0.091|| |[[:results:exp85|UM0129480 7μM R02 exp85]]|0.09|| |[[:results:exp529|Thimerosal 0.85μM R08 exp529]]|0.088|| |[[:results:exp488|Hippuristanol 0.12μM R08 exp488]]|0.077|| |[[:results:exp466|Cannabidiol 20μM R08 exp466]]|0.074|| |[[:results:exp290|LLY-283 2.6μM R06 exp290]]|0.074|| |[[:results:exp535|Trimetrexate 0.03μM R08 exp535]]|0.073|| |[[:results:exp431|Rotenone 0.07μM R08 exp431]]|0.071|| |[[:results:exp342|Calcium Ionophore 0.4μM R07 exp342]]|0.069|| |[[:results:exp116|AICAR 240μM R03 exp116]]|0.069|| |[[:results:exp497|Lead acetate 2000μM R08 exp497]]|0.067|| |[[:results:exp498|Lead acetate 2000μM R08 exp498 no dilution day6]]|0.066|| |[[:results:exp447|Amiloride 100μM R08 exp447]]|0.066|| |[[:results:exp65|Mubritinib 0.2μM R02 exp65]]|0.064|| |[[:results:exp359|FK-506 30μM R07 exp359]]|0.063|| |[[:results:exp440|Aphidicolin 0.4μM R08 exp440]]|0.063|| |[[:results:exp212|Phenformin 20μM R05 exp212]]|0.06|| |[[:results:exp513|ONC212 0.15μM R08 exp513]]|0.06|| |[[:results:exp357|Dorsomorphin 5μM R07 exp357]]|0.06|| |[[:results:exp234|Ethanol 0.01 R05 exp234]]|0.058|| |[[:results:exp445|∆-9-Tetrahydrocannabinol 30μM R08 exp445]]|0.057|| |[[:results:exp241|QNZ 0.01μM R05 exp241]]|0.057|| |[[:results:exp470|Chloroquine 32μM R08 exp470]]|0.057|| |[[:results:exp329|Hydroxyurea 100μM R07 exp329]]|0.057|| |[[:results:exp439|QNZ 0.01μM R08 exp439]]|0.057|| |[[:results:exp84|UM0125461 0.74μM R02 exp84]]|0.056|| |[[:results:exp474|CR131-b 0.005μM R08 exp474]]|0.055|| |[[:results:exp435|JQ1 0.8μM R08 exp435]]|0.055|| |[[:results:exp82|Torin1 0.08μM R02 exp82]]|0.054|| |[[:results:exp502|Milciclib 2μM R08 exp502]]|0.053|| |[[:results:exp407|Thapsigargin 0.005μM R07 exp407]]|0.053|| |[[:results:exp489|Hippuristanol 0.12μM R08 exp489 no dilution day6]]|0.052|| |[[:results:exp441|GSK-J4 1.5μM R08 exp441]]|0.052|| {{:chemogenomics:comparison_plots:exp25_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp400_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp492_vs_exp85.png?nolink |}} {{:chemogenomics:comparison_plots:exp492_vs_exp529.png?nolink |}} {{:chemogenomics:comparison_plots:exp488_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp466_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp290_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp492_vs_exp535.png?nolink |}} {{:chemogenomics:comparison_plots:exp431_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp342_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp116_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp492_vs_exp497.png?nolink |}} {{:chemogenomics:comparison_plots:exp492_vs_exp498.png?nolink |}} {{:chemogenomics:comparison_plots:exp447_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp492_vs_exp65.png?nolink |}} {{:chemogenomics:comparison_plots:exp359_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp440_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp212_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp492_vs_exp513.png?nolink |}} {{:chemogenomics:comparison_plots:exp357_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp234_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp445_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp241_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp470_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp329_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp439_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp492_vs_exp84.png?nolink |}} {{:chemogenomics:comparison_plots:exp474_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp435_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp492_vs_exp82.png?nolink |}} {{:chemogenomics:comparison_plots:exp492_vs_exp502.png?nolink |}} {{:chemogenomics:comparison_plots:exp407_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp489_vs_exp492.png?nolink |}} {{:chemogenomics:comparison_plots:exp441_vs_exp492.png?nolink |}} ^GO Term^Fold Change^Genes^ |regulation of anaphase-promoting complex-dependent catabolic process|443.81|CDK2,PLK1,CDC20| |regulation of proteasomal ubiquitin-dependent protein catabolic process|21.29|CDK2,PLK1,CDC20,OGT,KEAP1| |regulation of ubiquitin-dependent protein catabolic process|16.91|CDK2,PLK1,CDC20,OGT,KEAP1| |regulation of proteasomal protein catabolic process|15.65|CDK2,PLK1,CDC20,OGT,KEAP1| |transferase complex|6.44|PRKAG1,DERL2,MGA,CDK2,CDC20,POLA1,OGT,YPEL5,KEAP1| No GO term hits below threshold. (FDR <0.05)