BDBM50014706 2-{4-[2-(2,4-Diamino-pteridin-6-yl)-butyl]-benzoylamino}-pentanedioic acid::CHEMBL302068

SMILES CCC(Cc1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O)c1cnc2nc(N)nc(N)c2n1

InChI Key InChIKey=BRBJBKGSGUBGLP-UHFFFAOYSA-N

Data  2 KI  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 5 hits for monomerid = 50014706   

TargetDihydrofolate reductase(Mus musculus (Mouse))
Sri International

Curated by ChEMBL
LigandPNGBDBM50014706(2-{4-[2-(2,4-Diamino-pteridin-6-yl)-butyl]-benzoyl...)
Affinity DataKi:  0.00550nMAssay Description:Concentration of the compound inhibiting Dihydrofolate reductase derived from L1210 cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Mus musculus (Mouse))
Sri International

Curated by ChEMBL
LigandPNGBDBM50014706(2-{4-[2-(2,4-Diamino-pteridin-6-yl)-butyl]-benzoyl...)
Affinity DataKi:  8.20E+3nMAssay Description:Inhibitory activity towards Dihydrofolate reductase derived from human manca leukemia cellsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Homo sapiens (Human))
Sri International

Curated by ChEMBL
LigandPNGBDBM50014706(2-{4-[2-(2,4-Diamino-pteridin-6-yl)-butyl]-benzoyl...)
Affinity DataIC50:  70nMAssay Description:Binding affinity of the compound towards Dihydrofolate reductase derived from L1210 cells using [3H]- MTX as the radioligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetThymidylate synthase(Lactobacillus casei)
Sri International

Curated by ChEMBL
LigandPNGBDBM50014706(2-{4-[2-(2,4-Diamino-pteridin-6-yl)-butyl]-benzoyl...)
Affinity DataIC50: >1.00E+5nMAssay Description:Concentration of the compound inhibiting thymidylate synthase enzyme of L. caseiMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBifunctional purine biosynthesis protein ATIC(Mus musculus)
Sri International

Curated by ChEMBL
LigandPNGBDBM50014706(2-{4-[2-(2,4-Diamino-pteridin-6-yl)-butyl]-benzoyl...)
Affinity DataIC50: >5.00E+4nMAssay Description:Concentration of the compound inhibiting AICAR formyltransferase enzyme of L. caseiMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed