BDBM40736 (5,6-dimethoxy-8-quinolyl)-[4-(isopropylamino)-1-methyl-butyl]amine;oxalic acid::4-N-(5,6-dimethoxyquinolin-8-yl)-1-N-propan-2-ylpentane-1,4-diamine;oxalic acid::N4-(5,6-dimethoxy-8-quinolinyl)-N1-propan-2-ylpentane-1,4-diamine;oxalic acid::N4-(5,6-dimethoxyquinolin-8-yl)-N1-propan-2-yl-pentane-1,4-diamine;ethanedioic acid::cid_224641

SMILES COc1cc(NC(C)CCCNC(C)C)c2ncccc2c1OC

InChI Key InChIKey=KSJAKLHPKINFJD-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 40736   

TargetHeat shock protein HSP 90-alpha(Homo sapiens (Human))
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM40736((5,6-dimethoxy-8-quinolyl)-[4-(isopropylamino)-1-m...)
Affinity DataIC50: >5.00E+4nMAssay Description:Emory Chemistry-Biology Discovery Center Assay Overview: MLSCN Grant: 1 X01MH78953-01 Hsp90 is a chaperon with important roles in maintaining transfo...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetHeat shock protein HSP 90-alpha/90-beta(Homo sapiens (Human))
Emory University

Curated by ChEMBL
LigandPNGBDBM40736((5,6-dimethoxy-8-quinolyl)-[4-(isopropylamino)-1-m...)
Affinity DataIC50:  2.50E+4nMAssay Description:Inhibition of Hsp90 in human MCF7 cells assessed as Her2 level after 24 hrs by Western blotMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetHeat shock protein HSP 90-alpha/90-beta(Homo sapiens (Human))
Emory University

Curated by ChEMBL
LigandPNGBDBM40736((5,6-dimethoxy-8-quinolyl)-[4-(isopropylamino)-1-m...)
Affinity DataIC50:  4.40E+4nMAssay Description:Inhibition of Hsp90 in human MCF7 cell lysates assessed as interaction with Cy3b-conjugated geldanamycin by FP assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed