BDBM50320791 6-[(3,4-Dimethoxyanilino)methyl]-2,4-quinazolinediamine::CHEMBL1163286

SMILES COc1ccc(NCc2ccc3nc(N)nc(N)c3c2)cc1OC

InChI Key InChIKey=FDHLKVXBJSMYEW-UHFFFAOYSA-N

Data  3 KI  2 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 5 hits for monomerid = 50320791   

TargetDihydrofolate reductase(Human)
University of Alabama

Curated by ChEMBL
LigandPNGBDBM50320791(6-[(3,4-Dimethoxyanilino)methyl]-2,4-quinazolinedi...)
Affinity DataIC50: 85.5nMAssay Description:Inhibition of human DHFR by spectrophotometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/20/2010
Entry Details Article
PubMed
TargetBifunctional dihydrofolate reductase-thymidylate synthase(Trypanosoma cruzi)
University of Alabama

Curated by ChEMBL
LigandPNGBDBM50320791(6-[(3,4-Dimethoxyanilino)methyl]-2,4-quinazolinedi...)
Affinity DataIC50: 27.1nMAssay Description:Inhibition of Trypanosoma cruzi DHFR by spectrophotometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/20/2010
Entry Details Article
PubMed
TargetBifunctional dihydrofolate reductase-thymidylate synthase(Trypanosoma cruzi)
University of Alabama

Curated by ChEMBL
LigandPNGBDBM50320791(6-[(3,4-Dimethoxyanilino)methyl]-2,4-quinazolinedi...)
Affinity DataKi:  1.60nMAssay Description:Inhibition of Trypanosoma cruzi DHFR by spectrophotometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/20/2010
Entry Details Article
PubMed
TargetBifunctional dihydrofolate reductase-thymidylate synthase(Trypanosoma cruzi)
University of Alabama

Curated by ChEMBL
LigandPNGBDBM50320791(6-[(3,4-Dimethoxyanilino)methyl]-2,4-quinazolinedi...)
Affinity DataKi:  4.75nMAssay Description:Inhibition of Trypanosoma cruzi DHFR by Lineweaver-Burke plotMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/20/2010
Entry Details Article
PubMed
TargetDihydrofolate reductase(Human)
University of Alabama

Curated by ChEMBL
LigandPNGBDBM50320791(6-[(3,4-Dimethoxyanilino)methyl]-2,4-quinazolinedi...)
Affinity DataKi:  11.8nMAssay Description:Inhibition of human DHFR by spectrophotometric assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/20/2010
Entry Details Article
PubMed