BDBM50058420 (methylbenzoprim, MBP) 5-[4-(Benzyl-methyl-amino)-3-nitro-phenyl]-6-ethyl-pyrimidine-2,4-diamine::5-[4-(Benzyl-methyl-amino)-3-nitro-phenyl]-6-ethyl-pyrimidine-2,4-diamine::CHEMBL56170::cid_72438

SMILES CCc1nc(N)nc(N)c1-c1ccc(N(C)Cc2ccccc2)c(c1)[N+]([O-])=O

InChI Key InChIKey=NUFNKYNBZYIQDG-UHFFFAOYSA-N

Data  1 KI  8 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 9 hits for monomerid = 50058420   

TargetDihydrofolate reductase(Rattus norvegicus (rat))
University

Curated by ChEMBL
LigandPNGBDBM50058420((methylbenzoprim, MBP) 5-[4-(Benzyl-methyl-amino)-...)
Affinity DataKi:  0.00900nMAssay Description:Inhibitory activity of compound against rat liver Dihydrofolate reductaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProtein Wnt-3a(Mus musculus)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM50058420((methylbenzoprim, MBP) 5-[4-(Benzyl-methyl-amino)-...)
Affinity DataIC50:  5.28E+3nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetDihydrofolate reductase(Pneumocystis carinii)
University Of Nottingham

Curated by ChEMBL
LigandPNGBDBM50058420((methylbenzoprim, MBP) 5-[4-(Benzyl-methyl-amino)-...)
Affinity DataIC50:  1.60E+3nMAssay Description:In vitro inhibitory concentration against Pneumocystis carinii dihydrofolate reductaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Rattus norvegicus (rat))
University

Curated by ChEMBL
LigandPNGBDBM50058420((methylbenzoprim, MBP) 5-[4-(Benzyl-methyl-amino)-...)
Affinity DataIC50:  3.20nMAssay Description:Inhibitory activity against Dihydrofolate reductase from rat liver was evaluated using 90 microM dihydrofolic acid as substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Rattus norvegicus (rat))
University

Curated by ChEMBL
LigandPNGBDBM50058420((methylbenzoprim, MBP) 5-[4-(Benzyl-methyl-amino)-...)
Affinity DataIC50:  3.20nMAssay Description:In vitro inhibitory concentration against rat liver dihydrofolate reductaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydrofolate reductase(Pneumocystis carinii)
University Of Nottingham

Curated by ChEMBL
LigandPNGBDBM50058420((methylbenzoprim, MBP) 5-[4-(Benzyl-methyl-amino)-...)
Affinity DataIC50:  1.60E+3nMAssay Description:Inhibitory activity against Dihydrofolate reductase from Pneumocystis carinii was evaluated using 90 microM dihydrofolic acid as substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBifunctional dihydrofolate reductase-thymidylate synthase(Toxoplasma gondii)
University

Curated by ChEMBL
LigandPNGBDBM50058420((methylbenzoprim, MBP) 5-[4-(Benzyl-methyl-amino)-...)
Affinity DataIC50:  91nMAssay Description:Inhibitory activity against Dihydrofolate reductase from Toxoplasma gondii was evaluated using 90 microM dihydrofolic acid as substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetZinc finger protein GLI1(Mus musculus)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM50058420((methylbenzoprim, MBP) 5-[4-(Benzyl-methyl-amino)-...)
Affinity DataIC50:  1.57E+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
TargetBifunctional dihydrofolate reductase-thymidylate synthase(Toxoplasma gondii)
University

Curated by ChEMBL
LigandPNGBDBM50058420((methylbenzoprim, MBP) 5-[4-(Benzyl-methyl-amino)-...)
Affinity DataIC50:  91nMAssay Description:Inhibitory concentration against Toxoplasma gondii dihydrofolate reductaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed