iGMDRD438

Canonical SMILES: CCC(CC)(C=CCC(C)C1=CCC2C1(CCCC2=CC=C3CC(CC(C3=C)F)O)C)O

InChI: InChI=1S/C29H43FO2/c1-6-29(32,7-2)17-8-10-20(3)25-14-15-26-22(11-9-16-28(25,26)5)12-13-23-18-24(31)19-27(30)21(23)4/h8,12-14,17,20,24,26-27,31-32H,4,6-7,9-11,15-16,18-19H2,1-3,5H3/b17-8+,22-12+,23-13-/t20-,24+,26-,27-,28+/m0/s1

InChI Key: LRLWXBHFPGSUOX-GJQYOBCGSA-N

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Standard Name
Pubchem CID
DRUGBANK ID
Drug Status
Drug Type
Standard NameElocalcitol
Pubchem CID11396600
DRUGBANK IDDB06194
Drug StatusAlone
Drug TypeSmall Molecule


Drug Targets:

VDR (P11473)

Drug-model tissue-cancer distribution: Bubble Plot

BREAStissue: BREAS cancer: BREAST model num: 0BREASTtissue: BREAST cancer: undefined model num: 2

Drug-gene pathway enrichments

1pid: Urokinase-type plasminogen activator (uPA) and uPAR-mediated signaling1pid: Regulation of nuclear SMAD2/3 signaling1wikipathways: Selenium Micronutrient Network1wikipathways: Vitamin B12 Metabolism1wikipathways: Folate Metabolism1pid: p73 transcription factor network1pid: Direct p53 effectors1kegg: Chagas disease (American trypanosomiasis) - Homo sapiens (human)1pid: E2F transcription factor network1pid: HIF-1-alpha transcription factor network

Drug-gene GO enrichments

3MF: serine-type endopeptidase inhibitor activity2BP: negative regulation of plasminogen activation2BP: negative regulation of endopeptidase activity2CC: extracellular region2CC: extracellular space2CC: collagen-containing extracellular matrix1BP: cellular response to lipopolysaccharide1BP: cellular response to calcium ion1BP: positive regulation of monocyte chemotaxis1BP: defense response to Gram-negative bacterium

Drug-Gene: Aster Plot


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Gene ID
Gene Name
Model Num.
5054 SERPINE1 1
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Gene in drug-gene network: Network Plot

Models in Elocalcitol

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Model
Level
Reference ID
Tissue
Cancer
Drug
Clinical Response
Source
No matching records found

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