BDBM50059950 5-(4-{[4-(4,4-Dimethyl-4,5-dihydro-oxazol-2-yl)-benzyl]-methyl-amino}-3-nitro-phenyl)-6-ethyl-pyrimidine-2,4-diamine::CHEMBL103971

SMILES CCc1nc(N)nc(N)c1-c1ccc(N(C)Cc2ccc(cc2)C2=NC(C)(C)CO2)c(c1)[N+]([O-])=O

InChI Key InChIKey=WILIJFNSVIDRNY-UHFFFAOYSA-N

Data  3 IC50

  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 3 hits for monomerid = 50059950   

TargetDihydrofolate reductase(Pneumocystis carinii)
University

Curated by ChEMBL
LigandPNGBDBM50059950(5-(4-{[4-(4,4-Dimethyl-4,5-dihydro-oxazol-2-yl)-be...)
Affinity DataIC50: 950nMAssay Description:Inhibitory activity against Dihydrofolate reductase from Pneumocystis carinii was evaluated using 90 uM dihydrofolic acid as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetDihydrofolate reductase(Rat)
University

Curated by ChEMBL
LigandPNGBDBM50059950(5-(4-{[4-(4,4-Dimethyl-4,5-dihydro-oxazol-2-yl)-be...)
Affinity DataIC50: 15nMAssay Description:Inhibitory activity against Dihydrofolate reductase from rat liver was evaluated using 90 uM dihydrofolic acid as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetBifunctional dihydrofolate reductase-thymidylate synthase(Toxoplasma gondii)
University

Curated by ChEMBL
LigandPNGBDBM50059950(5-(4-{[4-(4,4-Dimethyl-4,5-dihydro-oxazol-2-yl)-be...)
Affinity DataIC50: 14nMAssay Description:Inhibitory activity against Dihydrofolate reductase from Toxoplasma gondii was evaluated using 90 uM dihydrofolic acid as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed