iGMDRD66

Canonical SMILES: CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)CO)O)N)O

InChI: InChI=1S/C27H29NO11/c1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34/h3-5,10,13,15,17,22,29,31,33,35-36H,6-9,28H2,1-2H3/t10-,13-,15-,17-,22+,27-/m0/s1

InChI Key: AOJJSUZBOXZQNB-TZSSRYMLSA-N

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Standard Name
CHEMBL
Pubchem CID
KEGG Drug ID
DRUGBANK ID
Drug Status
Drug targets (TTD)
Drug Type
Standard NameDoxorubicin
CHEMBLCHEMBL53463 CHEMBL216371 CHEMBL272706 CHEMBL359744
Pubchem CID31703
KEGG Drug IDD03899
DRUGBANK IDDB00997
Drug StatusAlone
Drug targets (TTD)DNC000163
Drug TypeSmall Molecule




Drug-model tissue-cancer distribution: Bubble Plot

UTERUtissue: UTERU cancer: UTERUS model num: 0UTERUStissue: UTERUS cancer: undefined model num: 1BLOOtissue: BLOO cancer: BLOOD model num: 0BLOODtissue: BLOOD cancer: undefined model num: 3undefinetissue: undefine cancer: undefined model num: 0undefinedtissue: undefined cancer: PANCAN model num: 34BOWEtissue: BOWE cancer: BOWEL model num: 0BOWELtissue: BOWEL cancer: undefined model num: 1BREAStissue: BREAS cancer: BREAST model num: 0BREASTtissue: BREAST cancer: undefined model num: 1BREASTtissue: BREAST cancer: Breast Carcinoma model num: 4SKItissue: SKI cancer: SKIN model num: 0SKINtissue: SKIN cancer: undefined model num: 1SKINtissue: SKIN cancer: Cutaneous Melanoma (SKCM) model num: 1BONtissue: BON cancer: BONE model num: 0BONEtissue: BONE cancer: Acute Myeloid Leukemia (AML) model num: 2BLADDEtissue: BLADDE cancer: BLADDER model num: 0BLADDERtissue: BLADDER cancer: Bladder Cancer model num: 2BLADDERtissue: BLADDER cancer: Bladder Urothelial Carcinoma (BLCA) model num: 1OVARtissue: OVAR cancer: OVARY model num: 0OVARYtissue: OVARY cancer: Ovarian Cancer model num: 3LYMPtissue: LYMP cancer: LYMPH model num: 0LYMPHtissue: LYMPH cancer: Mantle Cell Lymphoma (MCL) model num: 2PANCREAtissue: PANCREA cancer: PANCREAS model num: 0PANCREAStissue: PANCREAS cancer: Pancreatic Adenocarcinoma (PAAD) 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.
7514 XPO1 1
5295 PIK3R1 1
83481 EPPK1 2
4170 MCL1 2
Showing 1 to 4 of 24 rows rows per page

Gene in drug-gene network: Network Plot

Models in Doxorubicin

Model
Level
Reference ID
Tissue
Cancer
Drug
Clinical Response
Source
EXP(EPPK1) protein MCLP UTERUS undefined doxorubicin resistance in vitro
EXP(P27_pT198) protein MCLP BLOOD undefined Doxorubicin sensitivity in vitro
EXP(GCN5L2) protein MCLP BLOOD undefined Doxorubicin resistance in vitro
EXP(EIF2A_pS51) protein MCLP BLOOD undefined Doxorubicin resistance in vitro
EXP(CDK1) protein MCLP undefined PANCAN Doxorubicin resistance in vitro
EXP(CHK2_pT68) protein MCLP undefined PANCAN Doxorubicin sensitivity in vitro
EXP(CYCLINB1) protein MCLP undefined PANCAN Doxorubicin resistance in vitro
EXP(ERALPHA) protein MCLP undefined PANCAN Doxorubicin sensitivity in vitro
EXP(PR) protein MCLP undefined PANCAN Doxorubicin sensitivity in vitro
EXP(NDRG1_pT346) protein MCLP undefined PANCAN Doxorubicin sensitivity in vitro
Showing 1 to 10 of 57 rows rows per page

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