BDBM50171512 (S)-2-{4-[4-(2,4-Diamino-furo[2,3-d]pyrimidin-5-yl)-butyl]-benzoylamino}-pentanedioic acid::CHEMBL193275

SMILES Nc1nc(N)c2c(CCCCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)coc2n1

InChI Key InChIKey=RPOKXCAAPGZJKX-UHFFFAOYSA-N

Data  6 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50171512   

TargetDihydrofolate reductase(Lactobacillus casei)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50171512((S)-2-{4-[4-(2,4-Diamino-furo[2,3-d]pyrimidin-5-yl...)
Affinity DataIC50: 1.00E+4nMpH: 7.4Assay Description:Inhibition of Lactobacillus casei dihydrofolate reductase at 37 degree C pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed
TargetThymidylate synthase(Human)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50171512((S)-2-{4-[4-(2,4-Diamino-furo[2,3-d]pyrimidin-5-yl...)
Affinity DataIC50: 1.80E+4nMpH: 7.4Assay Description:Inhibition of human thymidylate synthetase at 37 degree C pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed
TargetDihydrofolate reductase(Escherichia coli)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50171512((S)-2-{4-[4-(2,4-Diamino-furo[2,3-d]pyrimidin-5-yl...)
Affinity DataIC50: 2.10E+4nMpH: 7.4Assay Description:Inhibition of Escherichia coli dihydrofolate reductase at 37 degree C pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed
TargetDihydrofolate reductase(Human)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50171512((S)-2-{4-[4-(2,4-Diamino-furo[2,3-d]pyrimidin-5-yl...)
Affinity DataIC50: 2.10E+4nMpH: 7.4Assay Description:Inhibition of human dihydrofolate reductase at 37 degree C pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed
TargetThymidylate synthase(Escherichia coli)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50171512((S)-2-{4-[4-(2,4-Diamino-furo[2,3-d]pyrimidin-5-yl...)
Affinity DataIC50: 1.00E+5nMpH: 7.4Assay Description:Inhibition of Escherichia coli thymidylate synthetase at 37 degree C pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed
TargetThymidylate synthase(Lactobacillus casei)
Duquesne University

Curated by ChEMBL
LigandPNGBDBM50171512((S)-2-{4-[4-(2,4-Diamino-furo[2,3-d]pyrimidin-5-yl...)
Affinity DataIC50: 1.00E+5nMpH: 7.4Assay Description:Inhibition of Lactobacillus casei thymidylate synthetase at 37 degree C pH 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed