iGMDRD585

Canonical SMILES: CC(C)S(=O)(=O)C1=CC=CC=C1NC2=CC(=NC3=C2C=CN3)NC4=C(C=C(C=C4)N5CCC(CC5)O)OC

InChI: InChI=1S/C28H33N5O4S/c1-18(2)38(35,36)26-7-5-4-6-23(26)30-24-17-27(32-28-21(24)10-13-29-28)31-22-9-8-19(16-25(22)37-3)33-14-11-20(34)12-15-33/h4-10,13,16-18,20,34H,11-12,14-15H2,1-3H3,(H3,29,30,31,32)

InChI Key: NMJMRSQTDLRCRQ-UHFFFAOYSA-N

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Standard Name
Pubchem CID
Drug Status
Drug Type
Standard NameMPS1-IN-1
Pubchem CID25195400
Drug StatusAlone
Drug TypeSmall Molecule

Drug Targets:

MPS1

Drug Pathways:

Mitosis

Drug-model tissue-cancer distribution: Bubble Plot

undefinetissue: undefine cancer: undefined model num: 0undefinedtissue: undefined cancer: PANCAN model num: 4STOMACtissue: STOMAC cancer: STOMACH model num: 0STOMACHtissue: STOMACH cancer: Esophageal Adenocarcinoma (ESCA) model num: 1BONtissue: BON cancer: BONE model num: 0BONEtissue: BONE cancer: Acute Myeloid Leukemia (AML) model num: 1

Drug-gene pathway enrichments

Drug-gene GO enrichments

Drug-Gene: Aster Plot


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Gene ID
Gene Name
Model Num.
9757 KMT2B 1
54790 TET2 1
23499 MACF1 1
Showing 1 to 3 of 3 rows

Gene in drug-gene network: Network Plot

Models in MPS1-IN-1

Model
Level
Reference ID
Tissue
Cancer
Drug
Clinical Response
Source
AMP(ARFGAP1,GNAS) gene GDSC undefined PANCAN MPS-1-IN-1 resistance in vitro
FUS(EWSR1-FLI1) gene GDSC undefined PANCAN MPS-1-IN-1 sensitivity in vitro
MUT(MLL2) gene GDSC undefined PANCAN MPS-1-IN-1 sensitivity in vitro
MUT(EWSR1-FLI1)|DEL(7q31.1)|AMP(PIP5K1A,SETDB1)|AMP(MDM4,PIK3C2B,ZC3H11A) mix GDSC undefined PANCAN MPS-1-IN-1 sensitivity in vitro
MUT(MACF1) mix GDSC STOMACH Esophageal Adenocarcinoma (ESCA) MPS-1-IN-1 sensitivity in vitro
MUT(TET2) mix GDSC BONE Acute Myeloid Leukemia (AML) MPS-1-IN-1 sensitivity in vitro
Showing 1 to 6 of 6 rows

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