BDBM40838 7-[(3,5-dimethoxy-4-oxidanyl-phenyl)-(pyridin-2-ylamino)methyl]-2-methyl-quinolin-8-ol::7-[(4-hydroxy-3,5-dimethoxy-phenyl)-(2-pyridylamino)methyl]-2-methyl-quinolin-8-ol::7-[(4-hydroxy-3,5-dimethoxyphenyl)(pyridin-2-ylamino)methyl]-2-methylquinolin-8-ol::7-[(4-hydroxy-3,5-dimethoxyphenyl)-(2-pyridinylamino)methyl]-2-methyl-8-quinolinol::7-[(4-hydroxy-3,5-dimethoxyphenyl)-(pyridin-2-ylamino)methyl]-2-methylquinolin-8-ol::MLS000043303::SMR000019923::cid_3236321

SMILES COc1cc(cc(OC)c1O)C(Nc1ccccn1)c1ccc2ccc(C)nc2c1O

InChI Key InChIKey=JIJUNVBLNUUGJC-UHFFFAOYSA-N

Data  6 IC50  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 40838   

TargetComplement C1s subcomponent(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM40838(7-[(3,5-dimethoxy-4-oxidanyl-phenyl)-(pyridin-2-yl...)
Affinity DataIC50: >5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Dr. Scott L. Diamond, University of Pen...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetEphrin type-A receptor 4(Mus musculus)
Sanford-Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM40838(7-[(3,5-dimethoxy-4-oxidanyl-phenyl)-(pyridin-2-yl...)
Affinity DataIC50:  2.02E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetEphrin type-A receptor 4(Mus musculus)
Sanford-Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM40838(7-[(3,5-dimethoxy-4-oxidanyl-phenyl)-(pyridin-2-yl...)
Affinity DataIC50: >5.00E+4nMAssay Description:Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetHeat shock factor protein 1(Mus musculus)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM40838(7-[(3,5-dimethoxy-4-oxidanyl-phenyl)-(pyridin-2-yl...)
Affinity DataEC50:  4.22E+3nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetEstrogen receptor beta(Homo sapiens (Human))
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM40838(7-[(3,5-dimethoxy-4-oxidanyl-phenyl)-(pyridin-2-yl...)
Affinity DataIC50:  1.09E+5nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetEstrogen receptor beta(Homo sapiens (Human))
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM40838(7-[(3,5-dimethoxy-4-oxidanyl-phenyl)-(pyridin-2-yl...)
Affinity DataIC50:  3.13E+3nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetATP-dependent molecular chaperone HSP82(Candida albicans)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM40838(7-[(3,5-dimethoxy-4-oxidanyl-phenyl)-(pyridin-2-yl...)
Affinity DataEC50:  2.02E+3nMAssay Description:Broad Institute: Reversing Antifungal Drug Resistance Project ID: 2037 Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, Calcineurin, ...More data for this Ligand-Target Pair
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TargetInduced myeloid leukemia cell differentiation protein Mcl-1(Homo sapiens (Human))
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM40838(7-[(3,5-dimethoxy-4-oxidanyl-phenyl)-(pyridin-2-yl...)
Affinity DataIC50:  786nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay