BDBM50081917 5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine::CHEMBL31547

SMILES CCCCCCOc1cccc(Cc2cnc(N)nc2N)c1

InChI Key InChIKey=FBTWFHMLKCKSPR-UHFFFAOYSA-N

Data  17 KI

  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 17 hits for monomerid = 50081917   

TargetDihydrofolate reductase(Homo sapiens (Human))
Cardiff University

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  9.80nMAssay Description:Inhibition of recombinant Dihydrofolate reductase from humans.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Escherichia coli)
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  138nMAssay Description:Compound is evaluated for the inhibition of dihydrofolate reductase from Escherichia coliMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Salmonella enterica subsp. enterica serovar Typhi)
Pomona College

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  138nMAssay Description:Inhibitory activity against Escherichia coli dihydrofolate reductaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Escherichia coli)
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  138nMAssay Description:Inhibitory activity against dihydrofolate reductase (DHFR) from Escherichia coli (expressed as log 1/Kiapp)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Escherichia coli)
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  138nMAssay Description:Apparent inhibitory (log 1/Ki) activity against Escherichia coli dihydrofolate reductaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Escherichia coli)
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  151nMAssay Description:Inhibition constant against binding of Escherichia coli dihydrofolate reductaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Homo sapiens (Human))
Cardiff University

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  171nMAssay Description:Inhibition of recombinant Dihydrofolate reductase from Leishmania major.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Bos taurus (Cattle))
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  407nMpH: 7.2Assay Description:Inhibitory activity against bovine liver dihydrofolate reductase at pH 7.2.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Bos taurus (Cattle))
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  407nMpH: 7.2Assay Description:Inhibitory activity against bovine liver dihydrofolate reductase at pH 7.2.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Bos taurus (Cattle))
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  407nMAssay Description:Inhibition of dihydrofolate reductase from bovine liverMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Homo sapiens (Human))
Cardiff University

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  600nMAssay Description:Inhibition of recombinant Dihydrofolate reductase from Trypanosoma cruzi.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Lactobacillus casei)
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  1.70E+3nMAssay Description:Inhibitory activity against dihydrofolate reductase (DHFR) from Lactobacillus casei (expressed as log 1/Kiapp)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Lactobacillus casei)
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  1.70E+3nMAssay Description:Inhibitory activity against Lactobacillus casei dihydrofolate reductaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Homo sapiens (Human))
Cardiff University

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  1.90E+3nMAssay Description:Inhibition of recombinant Dihydrofolate reductase from humans.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Gallus gallus (Chicken))
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  2.14E+3nMpH: 7.2Assay Description:Inhibitory activity against chicken dihydrofolate reductase at pH 7.2.More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Gallus gallus (Chicken))
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  2.14E+3nMAssay Description:Inhibitory activity against chicken liver dihydrofolate reductaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Gallus gallus (Chicken))
TBA

Curated by ChEMBL
LigandPNGBDBM50081917(5-(3-Hexyloxy-benzyl)-pyrimidine-2,4-diamine | CHE...)
Affinity DataKi:  2.14E+3nMpH: 7.2Assay Description:Inhibition of bovine heart phosphodiesteraseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed