iGMDRD275

Canonical SMILES: CC1CC(C(C(C=C(C(C(C=CC=C(C(=O)NC2=CC(=O)C(=C(C1)C2=O)NCCN(C)C)C)OC)OC(=O)N)C)C)O)OC

InChI: InChI=1S/C32H48N4O8/c1-18-14-22-27(34-12-13-36(5)6)24(37)17-23(29(22)39)35-31(40)19(2)10-9-11-25(42-7)30(44-32(33)41)21(4)16-20(3)28(38)26(15-18)43-8/h9-11,16-18,20,25-26,28,30,34,38H,12-15H2,1-8H3,(H2,33,41)(H,35,40)/b11-9-,19-10+,21-16+/t18-,20+,25+,26+,28-,30+/m1/s1

InChI Key: KUFRQPKVAWMTJO-LMZWQJSESA-N

Loading, please wait...
Standard Name
CHEMBL
Pubchem CID
DRUGBANK ID
Drug Status
Drug Type
Standard Name17-DMAG
CHEMBLCHEMBL383824
Pubchem CID5288670
DRUGBANK IDDB12442
Drug StatusAlone
Drug TypeSmall Molecule


Drug Targets:

HSP90AA1 (P07900)

Drug-model tissue-cancer distribution: Bubble Plot

LUNtissue: LUN cancer: LUNG model num: 0LUNGtissue: LUNG cancer: Non-Small Cell Lung Cancer (NSCLC) model num: 4

Drug-gene pathway enrichments

1wikipathways: MET in type 1 papillary renal cell carcinoma1wikipathways: Differentiation Pathway1kegg: Non-small cell lung cancer - Homo sapiens (human)1kegg: Pathways in cancer - Homo sapiens (human)

Drug-gene GO enrichments

3CC: integral component of plasma membrane3MF: transmembrane receptor protein tyrosine kinase activity2BP: phosphorylation2MF: protein tyrosine kinase activity2BP: protein autophosphorylation1BP: positive regulation of kinase activity1BP: NIK/NF-kappaB signaling1BP: swimming behavior1BP: hippocampus development1BP: peptidyl-tyrosine phosphorylation

Drug-Gene: Aster Plot


Loading, please wait...
Gene ID
Gene Name
Model Num.
238 ALK 3
Showing 1 to 1 of 1 rows

Gene in drug-gene network: Network Plot

Models in 17-DMAG

Loading, please wait...
Model
Level
Reference ID
Tissue
Cancer
Drug
Clinical Response
Source
No matching records found

​​​​

SITE
DATATYPES
CLASSFICATION
Map

Copyright © 2018 Modellab | All Rights Reserved

Disclaimer: iGMDR is intended for research purposes only. Its information cannot be used for emergencies or medical or professional advice.